mirror of https://github.com/abinit/abinit.git
5549 lines
405 KiB
Plaintext
5549 lines
405 KiB
Plaintext
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.Version 10.1.4.5 of ABINIT, released Sep 2024.
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.(MPI version, prepared for a x86_64_linux_gnu13.2 computer)
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.Copyright (C) 1998-2025 ABINIT group .
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ABINIT comes with ABSOLUTELY NO WARRANTY.
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It is free software, and you are welcome to redistribute it
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under certain conditions (GNU General Public License,
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see ~abinit/COPYING or http://www.gnu.org/copyleft/gpl.txt).
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ABINIT is a project of the Universite Catholique de Louvain,
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Corning Inc. and other collaborators, see ~abinit/doc/developers/contributors.txt .
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Please read https://docs.abinit.org/theory/acknowledgments for suggested
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acknowledgments of the ABINIT effort.
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For more information, see https://www.abinit.org .
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.Starting date : Fri 13 Sep 2024.
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- ( at 19h08 )
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- input file -> /home/buildbot/ABINIT3/eos_gnu_13.2_mpich/trunk_merge-10.0/tests/TestBot_MPI1/v3_t29/t29.abi
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- output file -> t29.abo
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- root for input files -> t29i
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- root for output files -> t29o
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DATASET 1 : space group P2 3 (#195); Bravais cP (primitive cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 1.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 12 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 12 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 8 mffmem = 1 mkmem = 1
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mpw = 14 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.663 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 2 : space group F2 3 (#196); Bravais cF (face-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 2.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 6 mpssoang = 1 mqgrid = 3001
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natom = 12 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 12 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 8 mffmem = 1 mkmem = 1
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mpw = 5 nfft = 216 nkpt = 1
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================================================================================
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P This job should need less than 0.578 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.003 Mbytes ; DEN or POT disk file : 0.004 Mbytes.
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================================================================================
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DATASET 3 : space group I2 3 (#197); Bravais cI (body-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 3.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 12 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 12 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 8 mffmem = 1 mkmem = 1
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mpw = 7 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.661 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.003 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 4 : space group P2_1 3 (#198); Bravais cP (primitive cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 4.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 12 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 12 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 8 mffmem = 1 mkmem = 1
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mpw = 14 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.663 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 5 : space group I2_1 3 (#199); Bravais cI (body-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 5.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 12 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 12 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 8 mffmem = 1 mkmem = 1
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mpw = 7 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.661 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.003 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 6 : space group Pm -3 (#200); Bravais cP (primitive cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 6.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 14 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.768 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.005 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 7 : space group Pn -3 (#201); Bravais cP (primitive cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 7.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 14 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.768 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.005 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 8 : space group Fm -3 (#202); Bravais cF (face-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 8.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 6 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 5 nfft = 216 nkpt = 1
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================================================================================
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P This job should need less than 0.680 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.003 Mbytes ; DEN or POT disk file : 0.004 Mbytes.
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================================================================================
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DATASET 9 : space group Fd -3 (#203); Bravais cF (face-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 9.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 6 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 5 nfft = 216 nkpt = 1
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================================================================================
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P This job should need less than 0.680 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.003 Mbytes ; DEN or POT disk file : 0.004 Mbytes.
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================================================================================
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DATASET 10 : space group Im -3 (#204); Bravais cI (body-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 10.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 7 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.765 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 11 : space group Pa -3 (#205); Bravais cP (primitive cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 11.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 14 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.768 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.005 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 12 : space group Ia -3 (#206); Bravais cI (body-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 12.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 7 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.765 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 13 : space group P4 3 2 (#207); Bravais cP (primitive cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 13.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 14 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.768 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.005 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 14 : space group P4_2 3 2 (#208); Bravais cP (primitive cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 14.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 14 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.768 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.005 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 15 : space group F4 3 2 (#209); Bravais cF (face-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 15.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 6 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 5 nfft = 216 nkpt = 1
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================================================================================
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P This job should need less than 0.680 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.003 Mbytes ; DEN or POT disk file : 0.004 Mbytes.
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================================================================================
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DATASET 16 : space group F4_1 3 2 (#210); Bravais cF (face-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 16.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 6 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 5 nfft = 216 nkpt = 1
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================================================================================
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P This job should need less than 0.680 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.003 Mbytes ; DEN or POT disk file : 0.004 Mbytes.
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================================================================================
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DATASET 17 : space group I4 3 2 (#211); Bravais cI (body-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 17.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 7 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.765 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 18 : space group P4_3 3 2 (#212); Bravais cP (primitive cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 18.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 14 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.768 Mbytes of memory.
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Rough estimation (10% accuracy) of disk space for files :
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|
_ WF disk file : 0.005 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 19 : space group P4_1 3 2 (#213); Bravais cP (primitive cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 19.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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|
natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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|
nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 14 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.768 Mbytes of memory.
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|
Rough estimation (10% accuracy) of disk space for files :
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|
_ WF disk file : 0.005 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 20 : space group I4_1 3 2 (#214); Bravais cI (body-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 20.
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|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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|
natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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|
nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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|
occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 7 nfft = 512 nkpt = 1
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================================================================================
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|
P This job should need less than 0.765 Mbytes of memory.
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|
Rough estimation (10% accuracy) of disk space for files :
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|
_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 21 : space group P-4 3 m (#215); Bravais cP (primitive cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 21.
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intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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mpw = 14 nfft = 512 nkpt = 1
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================================================================================
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P This job should need less than 0.768 Mbytes of memory.
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|
Rough estimation (10% accuracy) of disk space for files :
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|
_ WF disk file : 0.005 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
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================================================================================
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DATASET 22 : space group F-4 3 m (#216); Bravais cF (face-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 22.
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|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 6 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
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occopt = 1 xclevel = 1
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- mband = 15 mffmem = 1 mkmem = 1
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|
mpw = 5 nfft = 216 nkpt = 1
|
|
================================================================================
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|
P This job should need less than 0.680 Mbytes of memory.
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|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.003 Mbytes ; DEN or POT disk file : 0.004 Mbytes.
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|
================================================================================
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DATASET 23 : space group I-4 3 m (#217); Bravais cI (body-center cubic)
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================================================================================
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Values of the parameters that define the memory need for DATASET 23.
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|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
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lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
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natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
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nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 15 mffmem = 1 mkmem = 1
|
|
mpw = 7 nfft = 512 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 0.765 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 24 : space group P-4 3 n (#218); Bravais cP (primitive cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 24.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
|
|
natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 15 mffmem = 1 mkmem = 1
|
|
mpw = 14 nfft = 512 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 0.768 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.005 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 25 : space group F-4 3 c (#219); Bravais cF (face-center cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 25.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 6 mpssoang = 1 mqgrid = 3001
|
|
natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 15 mffmem = 1 mkmem = 1
|
|
mpw = 5 nfft = 216 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 0.680 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.003 Mbytes ; DEN or POT disk file : 0.004 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 26 : space group I-4 3 d (#220); Bravais cI (body-center cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 26.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
|
|
natom = 24 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 24 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 15 mffmem = 1 mkmem = 1
|
|
mpw = 7 nfft = 512 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 0.765 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 27 : space group Pm -3 m (#221); Bravais cP (primitive cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 27.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
|
|
natom = 48 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 48 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 30 mffmem = 1 mkmem = 1
|
|
mpw = 14 nfft = 512 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 1.026 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.008 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 28 : space group Pn -3 n (#222); Bravais cP (primitive cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 28.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
|
|
natom = 48 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 48 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 30 mffmem = 1 mkmem = 1
|
|
mpw = 14 nfft = 512 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 1.026 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.008 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 29 : space group Pm -3 n (#223); Bravais cP (primitive cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 29.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
|
|
natom = 48 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 48 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 30 mffmem = 1 mkmem = 1
|
|
mpw = 14 nfft = 512 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 1.026 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.008 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 30 : space group Pn -3 m (#224); Bravais cP (primitive cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 30.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
|
|
natom = 48 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 48 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 30 mffmem = 1 mkmem = 1
|
|
mpw = 14 nfft = 512 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 1.026 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.008 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 31 : space group Fm -3 m (#225); Bravais cF (face-center cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 31.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 6 mpssoang = 1 mqgrid = 3001
|
|
natom = 48 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 48 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 30 mffmem = 1 mkmem = 1
|
|
mpw = 5 nfft = 216 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 0.930 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.004 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 32 : space group Fm -3 c (#226); Bravais cF (face-center cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 32.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 6 mpssoang = 1 mqgrid = 3001
|
|
natom = 48 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 48 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 30 mffmem = 1 mkmem = 1
|
|
mpw = 5 nfft = 216 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 0.930 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.004 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 33 : space group Fd -3 m (#227); Bravais cF (face-center cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 33.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 6 mpssoang = 1 mqgrid = 3001
|
|
natom = 48 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 48 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 30 mffmem = 1 mkmem = 1
|
|
mpw = 5 nfft = 216 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 0.930 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.004 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 34 : space group Fd -3 c (#228); Bravais cF (face-center cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 34.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 6 mpssoang = 1 mqgrid = 3001
|
|
natom = 48 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 48 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 30 mffmem = 1 mkmem = 1
|
|
mpw = 5 nfft = 216 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 0.930 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.004 Mbytes ; DEN or POT disk file : 0.004 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 35 : space group Im -3 m (#229); Bravais cI (body-center cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 35.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
|
|
natom = 48 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 48 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 30 mffmem = 1 mkmem = 1
|
|
mpw = 7 nfft = 512 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 1.021 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.005 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
|
|
================================================================================
|
|
|
|
DATASET 36 : space group Ia -3 d (#230); Bravais cI (body-center cubic)
|
|
================================================================================
|
|
Values of the parameters that define the memory need for DATASET 36.
|
|
intxc = 0 ionmov = 0 iscf = 7 lmnmax = 1
|
|
lnmax = 1 mgfft = 8 mpssoang = 1 mqgrid = 3001
|
|
natom = 48 nloc_mem = 1 nspden = 1 nspinor = 1
|
|
nsppol = 1 nsym = 48 n1xccc = 0 ntypat = 1
|
|
occopt = 1 xclevel = 1
|
|
- mband = 30 mffmem = 1 mkmem = 1
|
|
mpw = 7 nfft = 512 nkpt = 1
|
|
================================================================================
|
|
P This job should need less than 1.021 Mbytes of memory.
|
|
Rough estimation (10% accuracy) of disk space for files :
|
|
_ WF disk file : 0.005 Mbytes ; DEN or POT disk file : 0.006 Mbytes.
|
|
================================================================================
|
|
|
|
--------------------------------------------------------------------------------
|
|
------------- Echo of variables that govern the present computation ------------
|
|
--------------------------------------------------------------------------------
|
|
-
|
|
- outvars: echo of selected default values
|
|
- iomode0 = 0 , fftalg0 =512 , wfoptalg0 = 0
|
|
-
|
|
- outvars: echo of global parameters not present in the input file
|
|
- max_nthreads = 0
|
|
-
|
|
-outvars: echo values of preprocessed input variables --------
|
|
acell1 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell2 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell3 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell4 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell5 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell6 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell7 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell8 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell9 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell10 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell11 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell12 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell13 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell14 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell15 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell16 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell17 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell18 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell19 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell20 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell21 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell22 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell23 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell24 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell25 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell26 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell27 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell28 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell29 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell30 8.0000000000E+00 8.0000000000E+00 8.0000000000E+00 Bohr
|
|
acell31 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell32 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell33 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell34 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell35 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
acell36 1.0000000000E+00 1.0000000000E+00 1.0000000000E+00 Bohr
|
|
amu 1.00794000E+00
|
|
ecut 1.00000000E+00 Hartree
|
|
- fftalg 512
|
|
istwfk 2
|
|
jdtset 1 2 3 4 5 6 7 8 9 10
|
|
11 12 13 14 15 16 17 18 19 20
|
|
21 22 23 24 25 26 27 28 29 30
|
|
31 32 33 34 35 36
|
|
kptopt 0
|
|
P mkmem 1
|
|
natom1 12
|
|
natom2 12
|
|
natom3 12
|
|
natom4 12
|
|
natom5 12
|
|
natom6 24
|
|
natom7 24
|
|
natom8 24
|
|
natom9 24
|
|
natom10 24
|
|
natom11 24
|
|
natom12 24
|
|
natom13 24
|
|
natom14 24
|
|
natom15 24
|
|
natom16 24
|
|
natom17 24
|
|
natom18 24
|
|
natom19 24
|
|
natom20 24
|
|
natom21 24
|
|
natom22 24
|
|
natom23 24
|
|
natom24 24
|
|
natom25 24
|
|
natom26 24
|
|
natom27 48
|
|
natom28 48
|
|
natom29 48
|
|
natom30 48
|
|
natom31 48
|
|
natom32 48
|
|
natom33 48
|
|
natom34 48
|
|
natom35 48
|
|
natom36 48
|
|
nband1 8
|
|
nband2 8
|
|
nband3 8
|
|
nband4 8
|
|
nband5 8
|
|
nband6 15
|
|
nband7 15
|
|
nband8 15
|
|
nband9 15
|
|
nband10 15
|
|
nband11 15
|
|
nband12 15
|
|
nband13 15
|
|
nband14 15
|
|
nband15 15
|
|
nband16 15
|
|
nband17 15
|
|
nband18 15
|
|
nband19 15
|
|
nband20 15
|
|
nband21 15
|
|
nband22 15
|
|
nband23 15
|
|
nband24 15
|
|
nband25 15
|
|
nband26 15
|
|
nband27 30
|
|
nband28 30
|
|
nband29 30
|
|
nband30 30
|
|
nband31 30
|
|
nband32 30
|
|
nband33 30
|
|
nband34 30
|
|
nband35 30
|
|
nband36 30
|
|
ndtset 36
|
|
ngfft1 8 8 8
|
|
ngfft2 6 6 6
|
|
ngfft3 8 8 8
|
|
ngfft4 8 8 8
|
|
ngfft5 8 8 8
|
|
ngfft6 8 8 8
|
|
ngfft7 8 8 8
|
|
ngfft8 6 6 6
|
|
ngfft9 6 6 6
|
|
ngfft10 8 8 8
|
|
ngfft11 8 8 8
|
|
ngfft12 8 8 8
|
|
ngfft13 8 8 8
|
|
ngfft14 8 8 8
|
|
ngfft15 6 6 6
|
|
ngfft16 6 6 6
|
|
ngfft17 8 8 8
|
|
ngfft18 8 8 8
|
|
ngfft19 8 8 8
|
|
ngfft20 8 8 8
|
|
ngfft21 8 8 8
|
|
ngfft22 6 6 6
|
|
ngfft23 8 8 8
|
|
ngfft24 8 8 8
|
|
ngfft25 6 6 6
|
|
ngfft26 8 8 8
|
|
ngfft27 8 8 8
|
|
ngfft28 8 8 8
|
|
ngfft29 8 8 8
|
|
ngfft30 8 8 8
|
|
ngfft31 6 6 6
|
|
ngfft32 6 6 6
|
|
ngfft33 6 6 6
|
|
ngfft34 6 6 6
|
|
ngfft35 8 8 8
|
|
ngfft36 8 8 8
|
|
nkpt 1
|
|
nline 1
|
|
nstep 1
|
|
nsym1 12
|
|
nsym2 12
|
|
nsym3 12
|
|
nsym4 12
|
|
nsym5 12
|
|
nsym6 24
|
|
nsym7 24
|
|
nsym8 24
|
|
nsym9 24
|
|
nsym10 24
|
|
nsym11 24
|
|
nsym12 24
|
|
nsym13 24
|
|
nsym14 24
|
|
nsym15 24
|
|
nsym16 24
|
|
nsym17 24
|
|
nsym18 24
|
|
nsym19 24
|
|
nsym20 24
|
|
nsym21 24
|
|
nsym22 24
|
|
nsym23 24
|
|
nsym24 24
|
|
nsym25 24
|
|
nsym26 24
|
|
nsym27 48
|
|
nsym28 48
|
|
nsym29 48
|
|
nsym30 48
|
|
nsym31 48
|
|
nsym32 48
|
|
nsym33 48
|
|
nsym34 48
|
|
nsym35 48
|
|
nsym36 48
|
|
ntypat 1
|
|
occ1 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
|
|
0.000000 0.000000
|
|
occ2 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
|
|
0.000000 0.000000
|
|
occ3 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
|
|
0.000000 0.000000
|
|
occ4 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000
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occ5 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000
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occ6 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ7 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ8 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ9 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ10 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ11 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ12 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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occ13 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ14 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ15 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ16 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ17 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ18 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ19 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ20 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ21 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ22 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ23 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ24 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ25 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ26 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000
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occ27 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
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occ28 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
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occ29 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
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occ30 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
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occ31 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
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occ32 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
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occ33 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
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occ34 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
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occ35 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
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occ36 2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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2.000000 2.000000 2.000000 2.000000 2.000000 2.000000
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0.000000 0.000000 0.000000 0.000000 0.000000 0.000000
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prtvol -1
|
|
rprim1 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim2 0.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 0.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 0.0000000000E+00
|
|
rprim3 -4.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 -4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 -4.0000000000E+00
|
|
rprim4 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim5 -4.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 -4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 -4.0000000000E+00
|
|
rprim6 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim7 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim8 0.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 0.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 0.0000000000E+00
|
|
rprim9 0.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 0.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 0.0000000000E+00
|
|
rprim10 -4.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 -4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 -4.0000000000E+00
|
|
rprim11 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim12 -4.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 -4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 -4.0000000000E+00
|
|
rprim13 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim14 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim15 0.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 0.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 0.0000000000E+00
|
|
rprim16 0.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 0.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 0.0000000000E+00
|
|
rprim17 -4.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 -4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 -4.0000000000E+00
|
|
rprim18 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim19 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim20 -4.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 -4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 -4.0000000000E+00
|
|
rprim21 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim22 0.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 0.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 0.0000000000E+00
|
|
rprim23 -4.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 -4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 -4.0000000000E+00
|
|
rprim24 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim25 0.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 0.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 0.0000000000E+00
|
|
rprim26 -4.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 -4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 -4.0000000000E+00
|
|
rprim27 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim28 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim29 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim30 1.0000000000E+00 0.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 1.0000000000E+00 0.0000000000E+00
|
|
0.0000000000E+00 0.0000000000E+00 1.0000000000E+00
|
|
rprim31 0.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 0.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 0.0000000000E+00
|
|
rprim32 0.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 0.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 0.0000000000E+00
|
|
rprim33 0.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 0.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 0.0000000000E+00
|
|
rprim34 0.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 0.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 0.0000000000E+00
|
|
rprim35 -4.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 -4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 -4.0000000000E+00
|
|
rprim36 -4.0000000000E+00 4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 -4.0000000000E+00 4.0000000000E+00
|
|
4.0000000000E+00 4.0000000000E+00 -4.0000000000E+00
|
|
spgroup1 195
|
|
spgroup2 196
|
|
spgroup3 197
|
|
spgroup4 198
|
|
spgroup5 199
|
|
spgroup6 200
|
|
spgroup7 201
|
|
spgroup8 202
|
|
spgroup9 203
|
|
spgroup10 204
|
|
spgroup11 205
|
|
spgroup12 206
|
|
spgroup13 207
|
|
spgroup14 208
|
|
spgroup15 209
|
|
spgroup16 210
|
|
spgroup17 211
|
|
spgroup18 212
|
|
spgroup19 213
|
|
spgroup20 214
|
|
spgroup21 215
|
|
spgroup22 216
|
|
spgroup23 217
|
|
spgroup24 218
|
|
spgroup25 219
|
|
spgroup26 220
|
|
spgroup27 221
|
|
spgroup28 222
|
|
spgroup29 223
|
|
spgroup30 224
|
|
spgroup31 225
|
|
spgroup32 226
|
|
spgroup33 227
|
|
spgroup34 228
|
|
spgroup35 229
|
|
spgroup36 230
|
|
symafm1 1 1 1 1 1 1 1 1 1 1
|
|
1 1
|
|
symafm2 1 1 1 1 1 1 1 1 1 1
|
|
1 1
|
|
symafm3 1 1 1 1 1 1 1 1 1 1
|
|
1 1
|
|
symafm4 1 1 1 1 1 1 1 1 1 1
|
|
1 1
|
|
symafm5 1 1 1 1 1 1 1 1 1 1
|
|
1 1
|
|
symafm6 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm7 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm8 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm9 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm10 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm11 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm12 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm13 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm14 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm15 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm16 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm17 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm18 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm19 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm20 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm21 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm22 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm23 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm24 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm25 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm26 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
symafm27 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
symafm28 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
symafm29 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
symafm30 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1
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symafm31 1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1
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symafm32 1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1
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symafm33 1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1
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symafm34 1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1
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symafm35 1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1
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symafm36 1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1 1 1
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1 1 1 1 1 1 1 1
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symrel1 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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1 0 0 0 -1 0 0 0 -1 0 0 1 1 0 0 0 1 0
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0 1 0 0 0 -1 -1 0 0 0 0 -1 -1 0 0 0 1 0
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0 0 -1 1 0 0 0 -1 0 0 0 1 -1 0 0 0 -1 0
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0 1 -1 1 0 -1 0 0 -1 0 -1 1 0 -1 0 1 -1 0
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0 -1 0 1 -1 0 0 -1 1 1 -1 0 0 -1 1 0 -1 0
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symrel3 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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0 1 0 1 0 0 -1 -1 -1 0 0 1 -1 -1 -1 1 0 0
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0 0 1 0 1 0 -1 -1 -1 1 0 0 -1 -1 -1 0 1 0
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0 1 0 -1 -1 -1 0 0 1 -1 -1 -1 0 1 0 1 0 0
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symrel4 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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1 0 0 0 -1 0 0 0 -1 0 -1 0 0 0 -1 1 0 0
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0 -1 0 0 0 1 -1 0 0 0 1 0 0 0 -1 -1 0 0
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0 0 1 1 0 0 0 1 0 0 0 -1 -1 0 0 0 1 0
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0 0 -1 1 0 0 0 -1 0 0 0 1 -1 0 0 0 -1 0
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symrel5 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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0 1 0 1 0 0 -1 -1 -1 0 0 1 -1 -1 -1 1 0 0
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1 0 0 -1 -1 -1 0 1 0 -1 -1 -1 1 0 0 0 0 1
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0 0 1 1 0 0 0 1 0 1 0 0 0 0 1 -1 -1 -1
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0 1 0 -1 -1 -1 0 0 1 -1 -1 -1 0 1 0 1 0 0
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symrel6 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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-1 0 0 0 -1 0 0 0 1 -1 0 0 0 1 0 0 0 -1
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0 0 1 1 0 0 0 1 0 0 -1 0 0 0 -1 1 0 0
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0 -1 0 0 0 1 -1 0 0 1 0 0 0 -1 0 0 0 -1
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0 1 0 0 0 -1 -1 0 0 0 0 -1 -1 0 0 0 1 0
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0 0 -1 1 0 0 0 -1 0 0 0 1 -1 0 0 0 -1 0
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-1 0 0 0 -1 0 0 0 -1 0 -1 0 0 0 -1 -1 0 0
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1 0 0 0 1 0 0 0 -1 1 0 0 0 -1 0 0 0 1
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0 0 -1 -1 0 0 0 -1 0 0 1 0 0 0 1 -1 0 0
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0 1 0 0 0 -1 1 0 0 -1 0 0 0 1 0 0 0 1
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0 -1 0 0 0 1 1 0 0 0 0 1 1 0 0 0 -1 0
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0 0 1 -1 0 0 0 1 0 0 0 -1 1 0 0 0 1 0
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symrel7 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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-1 0 0 0 -1 0 0 0 1 -1 0 0 0 1 0 0 0 -1
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-1 0 0 0 -1 0 0 0 -1 0 0 1 1 0 0 0 1 0
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0 -1 0 0 0 -1 1 0 0 0 -1 0 0 0 1 -1 0 0
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0 -1 0 0 0 -1 -1 0 0 1 0 0 0 -1 0 0 0 -1
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1 0 0 0 1 0 0 0 -1 0 1 0 0 0 -1 -1 0 0
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1 0 0 0 -1 0 0 0 1 0 0 -1 -1 0 0 0 1 0
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0 0 -1 1 0 0 0 -1 0 0 0 -1 -1 0 0 0 -1 0
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0 1 0 0 0 1 -1 0 0 0 0 1 -1 0 0 0 -1 0
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0 1 0 0 0 -1 1 0 0 -1 0 0 0 1 0 0 0 1
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0 -1 0 0 0 1 1 0 0 0 0 1 1 0 0 0 -1 0
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0 0 1 -1 0 0 0 1 0 0 0 -1 1 0 0 0 1 0
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symrel8 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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0 1 -1 1 0 -1 0 0 -1 0 -1 1 0 -1 0 1 -1 0
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0 0 1 1 0 0 0 1 0 -1 0 1 -1 1 0 -1 0 0
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1 0 -1 0 0 -1 0 1 -1 -1 0 0 -1 0 1 -1 1 0
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0 -1 0 1 -1 0 0 -1 1 1 -1 0 0 -1 1 0 -1 0
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-1 0 0 0 -1 0 0 0 -1 0 -1 0 0 0 -1 -1 0 0
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0 -1 1 -1 0 1 0 0 1 0 1 -1 0 1 0 -1 1 0
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0 0 -1 -1 0 0 0 -1 0 1 0 -1 1 -1 0 1 0 0
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-1 0 1 0 0 1 0 -1 1 1 0 0 1 0 -1 1 -1 0
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0 1 0 -1 1 0 0 1 -1 -1 1 0 0 1 -1 0 1 0
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1 -1 0 1 0 0 1 0 -1 0 0 1 0 -1 1 -1 0 1
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symrel9 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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0 1 -1 1 0 -1 0 0 -1 0 0 1 1 0 0 0 1 0
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-1 0 1 -1 1 0 -1 0 0 1 0 -1 0 0 -1 0 1 -1
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1 -1 0 0 -1 1 0 -1 0 -1 1 0 -1 0 0 -1 0 1
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0 0 -1 0 1 -1 1 0 -1 0 -1 0 1 -1 0 0 -1 1
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0 -1 1 0 -1 0 1 -1 0 -1 0 0 -1 0 1 -1 1 0
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0 -1 1 -1 0 1 0 0 1 0 0 -1 -1 0 0 0 -1 0
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1 0 -1 1 -1 0 1 0 0 -1 0 1 0 0 1 0 -1 1
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0 0 1 0 -1 1 -1 0 1 0 1 0 -1 1 0 0 1 -1
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0 1 -1 0 1 0 -1 1 0 1 0 0 1 0 -1 1 -1 0
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symrel10 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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0 1 0 1 0 0 -1 -1 -1 0 0 1 -1 -1 -1 1 0 0
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0 0 1 1 0 0 0 1 0 0 0 1 0 1 0 -1 -1 -1
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1 0 0 -1 -1 -1 0 1 0 -1 -1 -1 0 0 1 0 1 0
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0 1 0 -1 -1 -1 0 0 1 -1 -1 -1 0 1 0 1 0 0
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0 -1 0 -1 0 0 1 1 1 0 0 -1 1 1 1 -1 0 0
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0 0 -1 -1 0 0 0 -1 0 0 0 -1 0 -1 0 1 1 1
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1 1 1 -1 0 0 0 0 -1 -1 0 0 0 0 -1 1 1 1
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0 -1 0 1 1 1 0 0 -1 1 1 1 0 -1 0 -1 0 0
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symrel11 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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1 0 0 0 -1 0 0 0 -1 0 -1 0 0 0 -1 1 0 0
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0 -1 0 0 0 1 -1 0 0 0 1 0 0 0 -1 -1 0 0
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0 0 1 1 0 0 0 1 0 0 0 -1 -1 0 0 0 1 0
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0 0 -1 1 0 0 0 -1 0 0 0 1 -1 0 0 0 -1 0
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1 0 0 0 1 0 0 0 -1 1 0 0 0 -1 0 0 0 1
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0 1 0 0 0 -1 1 0 0 0 -1 0 0 0 1 1 0 0
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0 0 -1 -1 0 0 0 -1 0 0 0 1 1 0 0 0 -1 0
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0 0 1 -1 0 0 0 1 0 0 0 -1 1 0 0 0 1 0
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symrel12 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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0 1 0 1 0 0 -1 -1 -1 0 0 1 -1 -1 -1 1 0 0
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1 0 0 -1 -1 -1 0 1 0 -1 -1 -1 1 0 0 0 0 1
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0 1 0 -1 -1 -1 0 0 1 -1 -1 -1 0 1 0 1 0 0
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0 -1 0 -1 0 0 1 1 1 0 0 -1 1 1 1 -1 0 0
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1 1 1 0 0 -1 0 -1 0 0 0 -1 0 -1 0 1 1 1
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-1 0 0 1 1 1 0 -1 0 1 1 1 -1 0 0 0 0 -1
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0 0 -1 -1 0 0 0 -1 0 -1 0 0 0 0 -1 1 1 1
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0 -1 0 1 1 1 0 0 -1 1 1 1 0 -1 0 -1 0 0
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symrel13 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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-1 0 0 0 -1 0 0 0 1 -1 0 0 0 1 0 0 0 -1
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0 1 0 1 0 0 0 0 -1 0 0 1 1 0 0 0 1 0
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0 -1 0 0 0 -1 1 0 0 0 -1 0 0 0 1 -1 0 0
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0 0 1 0 1 0 -1 0 0 1 0 0 0 -1 0 0 0 -1
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0 -1 0 -1 0 0 0 0 -1 0 1 0 0 0 -1 -1 0 0
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0 1 0 -1 0 0 0 0 1 1 0 0 0 0 -1 0 1 0
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0 -1 0 1 0 0 0 0 1 0 0 -1 -1 0 0 0 1 0
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0 0 -1 1 0 0 0 -1 0 1 0 0 0 0 1 0 -1 0
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0 0 -1 0 -1 0 -1 0 0 0 0 1 -1 0 0 0 -1 0
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0 0 1 0 -1 0 1 0 0 0 0 -1 0 1 0 1 0 0
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symrel14 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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-1 0 0 0 -1 0 0 0 1 -1 0 0 0 1 0 0 0 -1
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0 1 0 1 0 0 0 0 -1 0 0 1 1 0 0 0 1 0
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0 -1 0 0 0 -1 1 0 0 0 -1 0 0 0 1 -1 0 0
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0 0 1 0 1 0 -1 0 0 1 0 0 0 -1 0 0 0 -1
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0 -1 0 -1 0 0 0 0 -1 0 1 0 0 0 -1 -1 0 0
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0 1 0 -1 0 0 0 0 1 1 0 0 0 0 -1 0 1 0
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0 -1 0 1 0 0 0 0 1 0 0 -1 -1 0 0 0 1 0
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0 0 -1 1 0 0 0 -1 0 1 0 0 0 0 1 0 -1 0
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0 0 -1 0 -1 0 -1 0 0 0 0 1 -1 0 0 0 -1 0
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symrel15 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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0 1 -1 1 0 -1 0 0 -1 0 -1 1 0 -1 0 1 -1 0
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1 -1 0 1 0 -1 1 0 0 -1 0 0 -1 0 1 -1 1 0
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1 0 -1 1 0 0 1 -1 0 0 -1 1 0 0 1 -1 0 1
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0 1 0 0 1 -1 -1 1 0 1 -1 0 0 -1 1 0 -1 0
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1 -1 0 1 0 -1 1 0 0 -1 0 0 -1 0 1 -1 1 0
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0 -1 0 -1 0 0 0 0 -1 0 -1 0 1 -1 0 0 -1 1
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1 0 -1 1 0 0 1 -1 0 0 -1 1 0 0 1 -1 0 1
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0 1 0 0 1 -1 -1 1 0 1 -1 0 0 -1 1 0 -1 0
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symrel17 1 0 0 0 1 0 0 0 1 0 1 0 0 0 1 1 0 0
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0 1 0 1 0 0 -1 -1 -1 0 0 1 -1 -1 -1 1 0 0
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0 -1 0 -1 0 0 0 0 -1 -1 -1 -1 1 0 0 0 0 1
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0 0 -1 1 1 1 0 -1 0 0 -1 0 1 1 1 -1 0 0
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1 1 1 0 0 -1 -1 0 0 1 0 0 0 0 1 -1 -1 -1
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0 1 0 1 0 0 0 0 -1 0 0 1 1 0 0 0 1 0
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0 -1 0 -1 0 0 0 0 -1 0 1 0 0 0 -1 -1 0 0
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tnons1 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons2 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons3 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons4 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons5 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons6 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons7 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons8 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons9 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons10 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons11 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons12 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons13 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons14 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons15 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons16 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.2500000 0.2500000 0.2500000 0.0000000 0.0000000 0.0000000
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0.2500000 0.2500000 0.2500000 0.0000000 0.0000000 0.0000000
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0.2500000 0.2500000 0.2500000 0.0000000 0.0000000 0.0000000
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tnons17 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons18 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons19 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.2500000 0.2500000 -0.2500000 0.0000000 0.5000000 0.5000000
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tnons20 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons21 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons22 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons23 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons24 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons25 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons26 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons27 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons28 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.0000000 0.0000000
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tnons29 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 -0.0000000 -0.0000000 -0.0000000
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0.5000000 0.5000000 0.5000000 -0.0000000 -0.0000000 -0.0000000
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0.5000000 0.5000000 0.5000000 -0.0000000 -0.0000000 -0.0000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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tnons30 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.0000000 0.0000000 0.0000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.0000000 0.0000000 0.0000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.5000000 0.5000000 0.5000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons31 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons32 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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tnons33 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.2500000 0.2500000 0.2500000 0.2500000 0.2500000 0.2500000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.2500000 0.2500000 0.2500000
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0.2500000 0.2500000 0.2500000 0.0000000 0.0000000 0.0000000
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0.2500000 0.2500000 0.2500000 0.2500000 0.2500000 0.2500000
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0.0000000 0.0000000 0.0000000 0.2500000 0.2500000 0.2500000
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0.2500000 0.2500000 0.2500000 0.2500000 0.2500000 0.2500000
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0.2500000 0.2500000 0.2500000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.2500000 0.2500000 0.2500000 0.2500000 0.2500000 0.2500000
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0.2500000 0.2500000 0.2500000 0.2500000 0.2500000 0.2500000
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0.0000000 0.0000000 0.0000000 0.2500000 0.2500000 0.2500000
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0.2500000 0.2500000 0.2500000 0.2500000 0.2500000 0.2500000
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0.0000000 0.0000000 0.0000000 0.2500000 0.2500000 0.2500000
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0.2500000 0.2500000 0.2500000 0.0000000 0.0000000 0.0000000
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0.2500000 0.2500000 0.2500000 0.2500000 0.2500000 0.2500000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.2500000 0.2500000 0.2500000
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0.2500000 0.2500000 0.2500000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.2500000 0.2500000 0.2500000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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tnons34 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.2500000 0.2500000 0.2500000 -0.2500000 -0.2500000 -0.2500000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.2500000 0.2500000 0.2500000
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-0.2500000 -0.2500000 -0.2500000 0.0000000 0.0000000 0.0000000
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0.2500000 0.2500000 0.2500000 -0.2500000 -0.2500000 -0.2500000
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0.0000000 0.0000000 0.0000000 0.2500000 0.2500000 0.2500000
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-0.2500000 -0.2500000 -0.2500000 0.2500000 0.2500000 0.2500000
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0.2500000 0.2500000 0.2500000 0.5000000 0.5000000 0.5000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.2500000 0.2500000 0.2500000 -0.2500000 -0.2500000 -0.2500000
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0.2500000 0.2500000 0.2500000 -0.2500000 -0.2500000 -0.2500000
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0.0000000 0.0000000 0.0000000 0.2500000 0.2500000 0.2500000
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-0.2500000 -0.2500000 -0.2500000 0.2500000 0.2500000 0.2500000
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0.5000000 0.5000000 0.5000000 -0.2500000 -0.2500000 -0.2500000
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0.2500000 0.2500000 0.2500000 0.5000000 0.5000000 0.5000000
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-0.2500000 -0.2500000 -0.2500000 0.2500000 0.2500000 0.2500000
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0.5000000 0.5000000 0.5000000 -0.2500000 -0.2500000 -0.2500000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.5000000 0.5000000
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tnons35 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000
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-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000
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-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000
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-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000
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-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000
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-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000
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-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000
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-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000
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-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000
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-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000
|
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tnons36 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.0000000 0.5000000 0.0000000 0.5000000 0.5000000
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0.5000000 0.0000000 0.0000000 0.0000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.0000000 0.5000000 0.0000000 0.5000000
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0.0000000 0.5000000 0.0000000 0.5000000 0.5000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.5000000 0.5000000
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0.0000000 0.5000000 0.0000000 0.5000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.5000000 0.0000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.0000000 0.0000000 0.0000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.0000000 0.5000000
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0.0000000 0.0000000 0.5000000 0.5000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.5000000 0.0000000
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-0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000 -0.0000000
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0.5000000 0.0000000 0.5000000 0.0000000 0.5000000 0.5000000
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0.5000000 0.0000000 0.0000000 -0.0000000 -0.0000000 -0.0000000
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0.5000000 0.5000000 0.0000000 0.5000000 0.0000000 0.5000000
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0.0000000 0.5000000 0.0000000 0.5000000 0.5000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.5000000 0.5000000
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0.0000000 0.5000000 0.0000000 0.5000000 0.0000000 0.0000000
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0.0000000 0.0000000 0.5000000 0.0000000 0.5000000 0.5000000
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0.5000000 0.5000000 0.0000000 0.0000000 0.0000000 0.5000000
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0.5000000 0.5000000 0.5000000 0.5000000 0.0000000 0.5000000
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0.0000000 0.0000000 0.5000000 0.5000000 0.0000000 0.0000000
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0.5000000 0.5000000 0.5000000 0.0000000 0.5000000 0.0000000
|
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toldfe 1.00000000E-06 Hartree
|
|
typat1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
typat2 1 1 1 1 1 1 1 1 1 1 1 1
|
|
typat3 1 1 1 1 1 1 1 1 1 1 1 1
|
|
typat4 1 1 1 1 1 1 1 1 1 1 1 1
|
|
typat5 1 1 1 1 1 1 1 1 1 1 1 1
|
|
typat6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat9 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat10 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat11 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat12 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat13 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat14 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat15 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat16 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat17 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat18 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat19 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat20 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat21 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat22 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat23 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat24 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat25 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat26 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1
|
|
typat27 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
typat28 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
typat29 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
typat30 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
typat31 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
typat32 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
typat33 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
typat34 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
typat35 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
typat36 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1
|
|
1 1 1 1 1 1 1 1
|
|
xangst1 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
3.5137366650E+00 3.5984050184E+00 4.6567594356E-01
|
|
3.5137366650E+00 6.3501265031E-01 3.7677417252E+00
|
|
7.1968100368E-01 3.5984050184E+00 3.7677417252E+00
|
|
6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
4.6567594356E-01 3.5137366650E+00 3.5984050184E+00
|
|
3.7677417252E+00 3.5137366650E+00 6.3501265031E-01
|
|
3.7677417252E+00 7.1968100368E-01 3.5984050184E+00
|
|
3.5984050184E+00 4.6567594356E-01 3.5137366650E+00
|
|
6.3501265031E-01 3.7677417252E+00 3.5137366650E+00
|
|
3.5984050184E+00 3.7677417252E+00 7.1968100368E-01
|
|
xangst2 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
1.3970278307E+00 1.4816961841E+00 4.6567594356E-01
|
|
1.3970278307E+00 6.3501265031E-01 1.6510328908E+00
|
|
7.1968100368E-01 1.4816961841E+00 1.6510328908E+00
|
|
6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
4.6567594356E-01 1.3970278307E+00 1.4816961841E+00
|
|
1.6510328908E+00 1.3970278307E+00 6.3501265031E-01
|
|
1.6510328908E+00 7.1968100368E-01 1.4816961841E+00
|
|
1.4816961841E+00 4.6567594356E-01 1.3970278307E+00
|
|
6.3501265031E-01 1.6510328908E+00 1.3970278307E+00
|
|
1.4816961841E+00 1.6510328908E+00 7.1968100368E-01
|
|
xangst3 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
1.3970278307E+00 1.4816961841E+00 2.5823847779E+00
|
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3.5137366650E+00 6.3501265031E-01 -4.6567594356E-01
|
|
-1.3970278307E+00 1.4816961841E+00 1.6510328908E+00
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6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
2.5823847779E+00 1.3970278307E+00 1.4816961841E+00
|
|
-4.6567594356E-01 3.5137366650E+00 6.3501265031E-01
|
|
1.6510328908E+00 -1.3970278307E+00 1.4816961841E+00
|
|
1.4816961841E+00 2.5823847779E+00 1.3970278307E+00
|
|
6.3501265031E-01 -4.6567594356E-01 3.5137366650E+00
|
|
1.4816961841E+00 1.6510328908E+00 -1.3970278307E+00
|
|
xangst4 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
1.3970278307E+00 3.5984050184E+00 2.5823847779E+00
|
|
3.5137366650E+00 2.7517214847E+00 1.6510328908E+00
|
|
2.8363898380E+00 1.4816961841E+00 3.7677417252E+00
|
|
2.5823847779E+00 1.3970278307E+00 3.5984050184E+00
|
|
1.6510328908E+00 3.5137366650E+00 2.7517214847E+00
|
|
3.7677417252E+00 2.8363898380E+00 1.4816961841E+00
|
|
6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
3.5984050184E+00 2.5823847779E+00 1.3970278307E+00
|
|
2.7517214847E+00 1.6510328908E+00 3.5137366650E+00
|
|
1.4816961841E+00 3.7677417252E+00 2.8363898380E+00
|
|
xangst5 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
1.3970278307E+00 -6.3501265031E-01 2.5823847779E+00
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|
1.3970278307E+00 6.3501265031E-01 -4.6567594356E-01
|
|
7.1968100368E-01 -6.3501265031E-01 1.6510328908E+00
|
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2.5823847779E+00 1.3970278307E+00 -6.3501265031E-01
|
|
-4.6567594356E-01 1.3970278307E+00 6.3501265031E-01
|
|
1.6510328908E+00 7.1968100368E-01 -6.3501265031E-01
|
|
6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
-6.3501265031E-01 2.5823847779E+00 1.3970278307E+00
|
|
6.3501265031E-01 -4.6567594356E-01 1.3970278307E+00
|
|
-6.3501265031E-01 1.6510328908E+00 7.1968100368E-01
|
|
xangst6 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
3.5137366650E+00 3.5984050184E+00 4.6567594356E-01
|
|
3.5137366650E+00 6.3501265031E-01 3.7677417252E+00
|
|
6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
4.6567594356E-01 3.5137366650E+00 3.5984050184E+00
|
|
3.7677417252E+00 3.5137366650E+00 6.3501265031E-01
|
|
7.1968100368E-01 3.5984050184E+00 3.7677417252E+00
|
|
3.7677417252E+00 7.1968100368E-01 3.5984050184E+00
|
|
3.5984050184E+00 4.6567594356E-01 3.5137366650E+00
|
|
6.3501265031E-01 3.7677417252E+00 3.5137366650E+00
|
|
3.5984050184E+00 3.7677417252E+00 7.1968100368E-01
|
|
3.5137366650E+00 3.5984050184E+00 3.7677417252E+00
|
|
3.7677417252E+00 3.5137366650E+00 3.5984050184E+00
|
|
7.1968100368E-01 6.3501265031E-01 3.7677417252E+00
|
|
7.1968100368E-01 3.5984050184E+00 4.6567594356E-01
|
|
3.5984050184E+00 3.7677417252E+00 3.5137366650E+00
|
|
3.7677417252E+00 7.1968100368E-01 6.3501265031E-01
|
|
4.6567594356E-01 7.1968100368E-01 3.5984050184E+00
|
|
3.5137366650E+00 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 3.5137366650E+00 6.3501265031E-01
|
|
6.3501265031E-01 3.7677417252E+00 7.1968100368E-01
|
|
3.5984050184E+00 4.6567594356E-01 7.1968100368E-01
|
|
6.3501265031E-01 4.6567594356E-01 3.5137366650E+00
|
|
xangst7 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
3.5137366650E+00 3.5984050184E+00 4.6567594356E-01
|
|
3.5137366650E+00 6.3501265031E-01 3.7677417252E+00
|
|
1.3970278307E+00 1.4816961841E+00 1.6510328908E+00
|
|
6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
4.6567594356E-01 3.5137366650E+00 3.5984050184E+00
|
|
3.7677417252E+00 3.5137366650E+00 6.3501265031E-01
|
|
1.6510328908E+00 1.3970278307E+00 1.4816961841E+00
|
|
7.1968100368E-01 3.5984050184E+00 3.7677417252E+00
|
|
2.8363898380E+00 2.7517214847E+00 1.6510328908E+00
|
|
3.7677417252E+00 7.1968100368E-01 3.5984050184E+00
|
|
2.8363898380E+00 1.4816961841E+00 2.5823847779E+00
|
|
3.5984050184E+00 4.6567594356E-01 3.5137366650E+00
|
|
6.3501265031E-01 3.7677417252E+00 3.5137366650E+00
|
|
1.4816961841E+00 1.6510328908E+00 1.3970278307E+00
|
|
1.6510328908E+00 2.8363898380E+00 2.7517214847E+00
|
|
3.5984050184E+00 3.7677417252E+00 7.1968100368E-01
|
|
2.5823847779E+00 2.8363898380E+00 1.4816961841E+00
|
|
1.3970278307E+00 2.7517214847E+00 2.5823847779E+00
|
|
2.5823847779E+00 1.3970278307E+00 2.7517214847E+00
|
|
2.7517214847E+00 1.6510328908E+00 2.8363898380E+00
|
|
1.4816961841E+00 2.5823847779E+00 2.8363898380E+00
|
|
2.7517214847E+00 2.5823847779E+00 1.3970278307E+00
|
|
xangst8 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
1.3970278307E+00 1.4816961841E+00 4.6567594356E-01
|
|
1.3970278307E+00 6.3501265031E-01 1.6510328908E+00
|
|
6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
4.6567594356E-01 1.3970278307E+00 1.4816961841E+00
|
|
1.6510328908E+00 1.3970278307E+00 6.3501265031E-01
|
|
7.1968100368E-01 1.4816961841E+00 1.6510328908E+00
|
|
1.6510328908E+00 7.1968100368E-01 1.4816961841E+00
|
|
1.4816961841E+00 4.6567594356E-01 1.3970278307E+00
|
|
6.3501265031E-01 1.6510328908E+00 1.3970278307E+00
|
|
1.4816961841E+00 1.6510328908E+00 7.1968100368E-01
|
|
3.5137366650E+00 3.5984050184E+00 3.7677417252E+00
|
|
3.7677417252E+00 3.5137366650E+00 3.5984050184E+00
|
|
2.8363898380E+00 2.7517214847E+00 3.7677417252E+00
|
|
2.8363898380E+00 3.5984050184E+00 2.5823847779E+00
|
|
3.5984050184E+00 3.7677417252E+00 3.5137366650E+00
|
|
3.7677417252E+00 2.8363898380E+00 2.7517214847E+00
|
|
2.5823847779E+00 2.8363898380E+00 3.5984050184E+00
|
|
3.5137366650E+00 2.7517214847E+00 2.5823847779E+00
|
|
2.5823847779E+00 3.5137366650E+00 2.7517214847E+00
|
|
2.7517214847E+00 3.7677417252E+00 2.8363898380E+00
|
|
3.5984050184E+00 2.5823847779E+00 2.8363898380E+00
|
|
2.7517214847E+00 2.5823847779E+00 3.5137366650E+00
|
|
xangst9 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
1.3970278307E+00 1.4816961841E+00 4.6567594356E-01
|
|
6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
4.6567594356E-01 1.3970278307E+00 1.4816961841E+00
|
|
1.6510328908E+00 1.3970278307E+00 6.3501265031E-01
|
|
1.4816961841E+00 4.6567594356E-01 1.3970278307E+00
|
|
6.3501265031E-01 1.6510328908E+00 1.3970278307E+00
|
|
1.4816961841E+00 1.6510328908E+00 7.1968100368E-01
|
|
1.6510328908E+00 7.1968100368E-01 1.4816961841E+00
|
|
1.3970278307E+00 6.3501265031E-01 1.6510328908E+00
|
|
7.1968100368E-01 1.4816961841E+00 1.6510328908E+00
|
|
3.3867341350E-01 4.2334176687E-01 5.9267847362E-01
|
|
5.9267847362E-01 3.3867341350E-01 4.2334176687E-01
|
|
1.7780354209E+00 1.6933670675E+00 5.9267847362E-01
|
|
4.2334176687E-01 5.9267847362E-01 3.3867341350E-01
|
|
5.9267847362E-01 1.7780354209E+00 1.6933670675E+00
|
|
1.5240303607E+00 1.7780354209E+00 4.2334176687E-01
|
|
1.6933670675E+00 5.9267847362E-01 1.7780354209E+00
|
|
4.2334176687E-01 1.5240303607E+00 1.7780354209E+00
|
|
1.6933670675E+00 1.5240303607E+00 3.3867341350E-01
|
|
1.5240303607E+00 3.3867341350E-01 1.6933670675E+00
|
|
1.7780354209E+00 4.2334176687E-01 1.5240303607E+00
|
|
3.3867341350E-01 1.6933670675E+00 1.5240303607E+00
|
|
xangst10 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
1.3970278307E+00 1.4816961841E+00 2.5823847779E+00
|
|
3.5137366650E+00 6.3501265031E-01 -4.6567594356E-01
|
|
6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
2.5823847779E+00 1.3970278307E+00 1.4816961841E+00
|
|
-4.6567594356E-01 3.5137366650E+00 6.3501265031E-01
|
|
-1.3970278307E+00 1.4816961841E+00 1.6510328908E+00
|
|
1.6510328908E+00 -1.3970278307E+00 1.4816961841E+00
|
|
1.4816961841E+00 2.5823847779E+00 1.3970278307E+00
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6.3501265031E-01 -4.6567594356E-01 3.5137366650E+00
|
|
1.4816961841E+00 1.6510328908E+00 -1.3970278307E+00
|
|
1.3970278307E+00 1.4816961841E+00 1.6510328908E+00
|
|
1.6510328908E+00 1.3970278307E+00 1.4816961841E+00
|
|
7.1968100368E-01 6.3501265031E-01 -4.6567594356E-01
|
|
-1.3970278307E+00 1.4816961841E+00 2.5823847779E+00
|
|
1.4816961841E+00 1.6510328908E+00 1.3970278307E+00
|
|
-4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
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2.5823847779E+00 -1.3970278307E+00 1.4816961841E+00
|
|
3.5137366650E+00 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 3.5137366650E+00 6.3501265031E-01
|
|
6.3501265031E-01 -4.6567594356E-01 7.1968100368E-01
|
|
1.4816961841E+00 2.5823847779E+00 -1.3970278307E+00
|
|
6.3501265031E-01 4.6567594356E-01 3.5137366650E+00
|
|
xangst11 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
1.3970278307E+00 3.5984050184E+00 2.5823847779E+00
|
|
3.5137366650E+00 2.7517214847E+00 1.6510328908E+00
|
|
2.8363898380E+00 1.4816961841E+00 3.7677417252E+00
|
|
2.5823847779E+00 1.3970278307E+00 3.5984050184E+00
|
|
1.6510328908E+00 3.5137366650E+00 2.7517214847E+00
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3.7677417252E+00 2.8363898380E+00 1.4816961841E+00
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6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
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3.5984050184E+00 2.5823847779E+00 1.3970278307E+00
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2.7517214847E+00 1.6510328908E+00 3.5137366650E+00
|
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1.4816961841E+00 3.7677417252E+00 2.8363898380E+00
|
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3.5137366650E+00 3.5984050184E+00 3.7677417252E+00
|
|
3.7677417252E+00 3.5137366650E+00 3.5984050184E+00
|
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2.8363898380E+00 6.3501265031E-01 1.6510328908E+00
|
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7.1968100368E-01 1.4816961841E+00 2.5823847779E+00
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1.3970278307E+00 2.7517214847E+00 4.6567594356E-01
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1.6510328908E+00 2.8363898380E+00 6.3501265031E-01
|
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2.5823847779E+00 7.1968100368E-01 1.4816961841E+00
|
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4.6567594356E-01 1.3970278307E+00 2.7517214847E+00
|
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3.5984050184E+00 3.7677417252E+00 3.5137366650E+00
|
|
6.3501265031E-01 1.6510328908E+00 2.8363898380E+00
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|
1.4816961841E+00 2.5823847779E+00 7.1968100368E-01
|
|
2.7517214847E+00 4.6567594356E-01 1.3970278307E+00
|
|
xangst12 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
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1.3970278307E+00 -6.3501265031E-01 2.5823847779E+00
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|
1.3970278307E+00 6.3501265031E-01 -4.6567594356E-01
|
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7.1968100368E-01 -6.3501265031E-01 1.6510328908E+00
|
|
2.5823847779E+00 1.3970278307E+00 -6.3501265031E-01
|
|
-4.6567594356E-01 1.3970278307E+00 6.3501265031E-01
|
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1.6510328908E+00 7.1968100368E-01 -6.3501265031E-01
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xangst13 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
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xangst14 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
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4.6567594356E-01 3.5137366650E+00 3.5984050184E+00
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1.6510328908E+00 2.7517214847E+00 2.8363898380E+00
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1.6510328908E+00 1.4816961841E+00 1.3970278307E+00
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xangst15 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
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xangst16 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
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xangst17 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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|
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xangst18 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
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xangst19 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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xangst20 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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xangst21 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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6.3501265031E-01 3.7677417252E+00 3.5137366650E+00
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xangst22 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
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xangst23 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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xangst24 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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xangst25 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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xangst26 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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xangst27 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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6.3501265031E-01 3.7677417252E+00 3.5137366650E+00
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7.1968100368E-01 3.7677417252E+00 6.3501265031E-01
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3.5984050184E+00 7.1968100368E-01 3.7677417252E+00
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6.3501265031E-01 3.7677417252E+00 7.1968100368E-01
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3.5984050184E+00 4.6567594356E-01 7.1968100368E-01
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3.5137366650E+00 4.6567594356E-01 3.5984050184E+00
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4.6567594356E-01 6.3501265031E-01 7.1968100368E-01
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6.3501265031E-01 4.6567594356E-01 3.5137366650E+00
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3.7677417252E+00 6.3501265031E-01 3.5137366650E+00
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3.7677417252E+00 3.5984050184E+00 7.1968100368E-01
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7.1968100368E-01 4.6567594356E-01 6.3501265031E-01
|
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7.1968100368E-01 3.7677417252E+00 3.5984050184E+00
|
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xangst28 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
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6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
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4.6567594356E-01 1.3970278307E+00 1.4816961841E+00
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1.6510328908E+00 1.3970278307E+00 6.3501265031E-01
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1.6510328908E+00 6.3501265031E-01 7.1968100368E-01
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7.1968100368E-01 1.4816961841E+00 1.6510328908E+00
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1.4816961841E+00 1.3970278307E+00 1.6510328908E+00
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1.6510328908E+00 7.1968100368E-01 1.4816961841E+00
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|
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7.1968100368E-01 4.6567594356E-01 1.4816961841E+00
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6.3501265031E-01 1.3970278307E+00 4.6567594356E-01
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6.3501265031E-01 1.6510328908E+00 1.3970278307E+00
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7.1968100368E-01 1.6510328908E+00 6.3501265031E-01
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4.6567594356E-01 1.4816961841E+00 7.1968100368E-01
|
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4.6567594356E-01 6.3501265031E-01 1.3970278307E+00
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1.3970278307E+00 1.6510328908E+00 1.4816961841E+00
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1.3970278307E+00 4.6567594356E-01 6.3501265031E-01
|
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3.5137366650E+00 3.5984050184E+00 3.7677417252E+00
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3.7677417252E+00 3.5137366650E+00 3.5984050184E+00
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2.8363898380E+00 2.7517214847E+00 3.7677417252E+00
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2.8363898380E+00 3.5984050184E+00 2.5823847779E+00
|
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3.5984050184E+00 3.5137366650E+00 2.5823847779E+00
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3.5984050184E+00 3.7677417252E+00 3.5137366650E+00
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3.7677417252E+00 2.8363898380E+00 2.7517214847E+00
|
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2.5823847779E+00 2.8363898380E+00 3.5984050184E+00
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2.5823847779E+00 3.5137366650E+00 2.7517214847E+00
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2.7517214847E+00 3.5137366650E+00 3.7677417252E+00
|
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3.5137366650E+00 3.7677417252E+00 2.7517214847E+00
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3.5984050184E+00 2.8363898380E+00 3.7677417252E+00
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2.7517214847E+00 3.7677417252E+00 2.8363898380E+00
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3.5984050184E+00 2.5823847779E+00 2.8363898380E+00
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3.5137366650E+00 2.5823847779E+00 3.5984050184E+00
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2.5823847779E+00 2.7517214847E+00 2.8363898380E+00
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2.7517214847E+00 2.5823847779E+00 3.5137366650E+00
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3.7677417252E+00 2.7517214847E+00 3.5137366650E+00
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3.7677417252E+00 3.5984050184E+00 2.8363898380E+00
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2.8363898380E+00 2.5823847779E+00 2.7517214847E+00
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2.8363898380E+00 3.7677417252E+00 3.5984050184E+00
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xangst29 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
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3.5137366650E+00 3.5984050184E+00 4.6567594356E-01
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3.5984050184E+00 3.7677417252E+00 3.5137366650E+00
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2.8363898380E+00 1.6510328908E+00 1.4816961841E+00
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xangst30 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
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2.5823847779E+00 2.7517214847E+00 1.3970278307E+00
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6.3501265031E-01 3.5137366650E+00 3.7677417252E+00
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4.6567594356E-01 6.3501265031E-01 7.1968100368E-01
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2.7517214847E+00 2.5823847779E+00 1.3970278307E+00
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|
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7.1968100368E-01 3.7677417252E+00 3.5984050184E+00
|
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xangst31 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
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3.7677417252E+00 2.7517214847E+00 2.8363898380E+00
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|
7.1968100368E-01 1.4816961841E+00 1.6510328908E+00
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3.5984050184E+00 3.5137366650E+00 3.7677417252E+00
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1.4816961841E+00 1.3970278307E+00 4.6567594356E-01
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3.5984050184E+00 3.7677417252E+00 3.5137366650E+00
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6.3501265031E-01 1.3970278307E+00 1.6510328908E+00
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1.3970278307E+00 1.6510328908E+00 6.3501265031E-01
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1.4816961841E+00 7.1968100368E-01 1.6510328908E+00
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2.7517214847E+00 3.7677417252E+00 2.8363898380E+00
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3.5984050184E+00 2.5823847779E+00 2.8363898380E+00
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1.3970278307E+00 4.6567594356E-01 1.4816961841E+00
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4.6567594356E-01 6.3501265031E-01 7.1968100368E-01
|
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2.7517214847E+00 2.5823847779E+00 3.5137366650E+00
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1.6510328908E+00 6.3501265031E-01 1.3970278307E+00
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1.6510328908E+00 1.4816961841E+00 7.1968100368E-01
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|
|
7.1968100368E-01 1.6510328908E+00 1.4816961841E+00
|
|
xangst32 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
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1.3970278307E+00 1.4816961841E+00 4.6567594356E-01
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1.3970278307E+00 6.3501265031E-01 1.6510328908E+00
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6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
4.6567594356E-01 1.3970278307E+00 1.4816961841E+00
|
|
1.6510328908E+00 1.3970278307E+00 6.3501265031E-01
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1.6510328908E+00 2.7517214847E+00 2.8363898380E+00
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7.1968100368E-01 1.4816961841E+00 1.6510328908E+00
|
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1.4816961841E+00 1.3970278307E+00 1.6510328908E+00
|
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1.6510328908E+00 7.1968100368E-01 1.4816961841E+00
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1.4816961841E+00 2.8363898380E+00 2.5823847779E+00
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|
2.8363898380E+00 2.5823847779E+00 1.4816961841E+00
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2.7517214847E+00 1.3970278307E+00 2.5823847779E+00
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1.4816961841E+00 4.6567594356E-01 1.3970278307E+00
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6.3501265031E-01 1.6510328908E+00 1.3970278307E+00
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2.8363898380E+00 1.6510328908E+00 2.7517214847E+00
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1.4816961841E+00 1.6510328908E+00 7.1968100368E-01
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2.5823847779E+00 2.7517214847E+00 1.3970278307E+00
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1.3970278307E+00 2.5823847779E+00 2.7517214847E+00
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3.5137366650E+00 3.5984050184E+00 3.7677417252E+00
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3.7677417252E+00 3.5137366650E+00 3.5984050184E+00
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2.8363898380E+00 2.7517214847E+00 3.7677417252E+00
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2.8363898380E+00 3.5984050184E+00 2.5823847779E+00
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1.4816961841E+00 1.3970278307E+00 2.5823847779E+00
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3.5984050184E+00 3.7677417252E+00 3.5137366650E+00
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3.5137366650E+00 2.7517214847E+00 2.5823847779E+00
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2.5823847779E+00 3.5137366650E+00 2.7517214847E+00
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2.7517214847E+00 1.3970278307E+00 1.6510328908E+00
|
|
1.3970278307E+00 1.6510328908E+00 2.7517214847E+00
|
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1.4816961841E+00 2.8363898380E+00 1.6510328908E+00
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2.7517214847E+00 3.7677417252E+00 2.8363898380E+00
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3.5984050184E+00 2.5823847779E+00 2.8363898380E+00
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1.3970278307E+00 2.5823847779E+00 1.4816961841E+00
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2.5823847779E+00 2.7517214847E+00 2.8363898380E+00
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2.7517214847E+00 2.5823847779E+00 3.5137366650E+00
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2.8363898380E+00 2.5823847779E+00 2.7517214847E+00
|
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2.8363898380E+00 1.6510328908E+00 1.4816961841E+00
|
|
xangst33 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
|
|
4.6567594356E-01 7.1968100368E-01 6.3501265031E-01
|
|
1.3970278307E+00 1.4816961841E+00 4.6567594356E-01
|
|
1.3970278307E+00 6.3501265031E-01 1.6510328908E+00
|
|
1.6933670675E+00 1.7780354209E+00 5.9267847362E-01
|
|
3.3867341350E-01 4.2334176687E-01 5.9267847362E-01
|
|
6.3501265031E-01 4.6567594356E-01 7.1968100368E-01
|
|
4.6567594356E-01 1.3970278307E+00 1.4816961841E+00
|
|
1.6510328908E+00 1.3970278307E+00 6.3501265031E-01
|
|
5.9267847362E-01 1.6933670675E+00 1.7780354209E+00
|
|
5.9267847362E-01 3.3867341350E-01 4.2334176687E-01
|
|
7.1968100368E-01 1.4816961841E+00 1.6510328908E+00
|
|
4.2334176687E-01 3.3867341350E-01 5.9267847362E-01
|
|
1.7780354209E+00 1.6933670675E+00 5.9267847362E-01
|
|
1.6510328908E+00 7.1968100368E-01 1.4816961841E+00
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|
4.2334176687E-01 1.7780354209E+00 1.5240303607E+00
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|
1.7780354209E+00 4.2334176687E-01 1.5240303607E+00
|
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1.7780354209E+00 1.5240303607E+00 4.2334176687E-01
|
|
1.6933670675E+00 3.3867341350E-01 1.5240303607E+00
|
|
1.4816961841E+00 1.3970278307E+00 4.6567594356E-01
|
|
1.4816961841E+00 4.6567594356E-01 1.3970278307E+00
|
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6.3501265031E-01 1.6510328908E+00 1.3970278307E+00
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|
1.7780354209E+00 5.9267847362E-01 1.6933670675E+00
|
|
4.2334176687E-01 5.9267847362E-01 3.3867341350E-01
|
|
5.9267847362E-01 4.2334176687E-01 3.3867341350E-01
|
|
5.9267847362E-01 1.7780354209E+00 1.6933670675E+00
|
|
1.4816961841E+00 1.6510328908E+00 7.1968100368E-01
|
|
1.5240303607E+00 4.2334176687E-01 1.7780354209E+00
|
|
1.5240303607E+00 1.7780354209E+00 4.2334176687E-01
|
|
1.5240303607E+00 1.6933670675E+00 3.3867341350E-01
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|
4.6567594356E-01 1.4816961841E+00 1.3970278307E+00
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|
3.3867341350E-01 1.6933670675E+00 1.5240303607E+00
|
|
3.3867341350E-01 5.9267847362E-01 4.2334176687E-01
|
|
6.3501265031E-01 7.1968100368E-01 4.6567594356E-01
|
|
1.5240303607E+00 3.3867341350E-01 1.6933670675E+00
|
|
3.3867341350E-01 1.5240303607E+00 1.6933670675E+00
|
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6.3501265031E-01 1.3970278307E+00 1.6510328908E+00
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xangst34 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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xangst35 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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xangst36 7.1968100368E-01 6.3501265031E-01 4.6567594356E-01
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xcart1 1.3600000000E+00 1.2000000000E+00 8.8000000000E-01
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xcart2 1.3600000000E+00 1.2000000000E+00 8.8000000000E-01
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xcart3 1.3600000000E+00 1.2000000000E+00 8.8000000000E-01
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xcart4 1.3600000000E+00 1.2000000000E+00 8.8000000000E-01
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1.2000000000E+00 7.1200000000E+00 1.3600000000E+00
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4.0000000000E-02 1.2000000000E-01 1.6000000000E-01
|
|
6.8000000000E-01 1.2000000000E-01 1.6000000000E-01
|
|
2.1000000000E-01 1.3000000000E-01 5.7000000000E-01
|
|
1.6000000000E-01 6.8000000000E-01 4.0000000000E-02
|
|
1.6000000000E-01 4.0000000000E-02 6.8000000000E-01
|
|
1.2000000000E-01 4.0000000000E-02 6.8000000000E-01
|
|
5.7000000000E-01 9.0000000000E-02 1.3000000000E-01
|
|
6.8000000000E-01 4.0000000000E-02 1.2000000000E-01
|
|
1.6000000000E-01 4.0000000000E-02 1.2000000000E-01
|
|
1.3000000000E-01 9.0000000000E-02 2.1000000000E-01
|
|
1.2000000000E-01 6.8000000000E-01 4.0000000000E-02
|
|
6.8000000000E-01 1.2000000000E-01 4.0000000000E-02
|
|
5.7000000000E-01 2.1000000000E-01 9.0000000000E-02
|
|
2.1000000000E-01 9.0000000000E-02 5.7000000000E-01
|
|
2.1000000000E-01 5.7000000000E-01 1.3000000000E-01
|
|
1.6000000000E-01 6.8000000000E-01 1.2000000000E-01
|
|
6.8000000000E-01 1.6000000000E-01 4.0000000000E-02
|
|
1.3000000000E-01 5.7000000000E-01 9.0000000000E-02
|
|
2.1000000000E-01 1.3000000000E-01 9.0000000000E-02
|
|
4.0000000000E-02 1.2000000000E-01 6.8000000000E-01
|
|
9.0000000000E-02 5.7000000000E-01 2.1000000000E-01
|
|
1.3000000000E-01 2.1000000000E-01 5.7000000000E-01
|
|
9.0000000000E-02 2.1000000000E-01 1.3000000000E-01
|
|
5.7000000000E-01 1.3000000000E-01 2.1000000000E-01
|
|
xred34 9.0000000000E-02 1.3000000000E-01 2.1000000000E-01
|
|
2.1000000000E-01 9.0000000000E-02 1.3000000000E-01
|
|
1.3000000000E-01 9.0000000000E-02 5.7000000000E-01
|
|
2.1000000000E-01 5.7000000000E-01 9.0000000000E-02
|
|
1.6000000000E-01 1.2000000000E-01 6.8000000000E-01
|
|
6.6000000000E-01 6.2000000000E-01 5.4000000000E-01
|
|
1.3000000000E-01 2.1000000000E-01 9.0000000000E-02
|
|
5.7000000000E-01 1.3000000000E-01 9.0000000000E-02
|
|
9.0000000000E-02 2.1000000000E-01 5.7000000000E-01
|
|
6.8000000000E-01 1.6000000000E-01 1.2000000000E-01
|
|
5.4000000000E-01 6.6000000000E-01 6.2000000000E-01
|
|
5.7000000000E-01 2.1000000000E-01 1.3000000000E-01
|
|
1.2000000000E-01 1.6000000000E-01 4.0000000000E-02
|
|
6.2000000000E-01 6.6000000000E-01 1.8000000000E-01
|
|
1.3000000000E-01 5.7000000000E-01 2.1000000000E-01
|
|
6.8000000000E-01 4.0000000000E-02 1.6000000000E-01
|
|
5.4000000000E-01 1.8000000000E-01 6.6000000000E-01
|
|
4.0000000000E-02 1.6000000000E-01 6.8000000000E-01
|
|
4.0000000000E-02 6.8000000000E-01 1.2000000000E-01
|
|
5.9000000000E-01 6.3000000000E-01 7.0000000000E-02
|
|
9.0000000000E-02 5.7000000000E-01 1.3000000000E-01
|
|
5.7000000000E-01 9.0000000000E-02 2.1000000000E-01
|
|
1.2000000000E-01 6.8000000000E-01 1.6000000000E-01
|
|
6.2000000000E-01 5.4000000000E-01 6.6000000000E-01
|
|
4.0000000000E-02 1.2000000000E-01 1.6000000000E-01
|
|
1.8000000000E-01 6.2000000000E-01 6.6000000000E-01
|
|
2.1000000000E-01 1.3000000000E-01 5.7000000000E-01
|
|
1.6000000000E-01 6.8000000000E-01 4.0000000000E-02
|
|
6.6000000000E-01 5.4000000000E-01 1.8000000000E-01
|
|
1.2000000000E-01 4.0000000000E-02 6.8000000000E-01
|
|
7.0000000000E-02 5.9000000000E-01 6.3000000000E-01
|
|
1.8000000000E-01 5.4000000000E-01 6.2000000000E-01
|
|
1.6000000000E-01 4.0000000000E-02 1.2000000000E-01
|
|
6.3000000000E-01 5.9000000000E-01 7.1000000000E-01
|
|
6.2000000000E-01 1.8000000000E-01 5.4000000000E-01
|
|
6.8000000000E-01 1.2000000000E-01 4.0000000000E-02
|
|
7.0000000000E-02 7.1000000000E-01 5.9000000000E-01
|
|
7.1000000000E-01 5.9000000000E-01 7.0000000000E-02
|
|
7.1000000000E-01 7.0000000000E-02 6.3000000000E-01
|
|
6.6000000000E-01 1.8000000000E-01 6.2000000000E-01
|
|
1.8000000000E-01 6.6000000000E-01 5.4000000000E-01
|
|
6.3000000000E-01 7.0000000000E-02 5.9000000000E-01
|
|
7.1000000000E-01 6.3000000000E-01 5.9000000000E-01
|
|
5.4000000000E-01 6.2000000000E-01 1.8000000000E-01
|
|
5.9000000000E-01 7.0000000000E-02 7.1000000000E-01
|
|
6.3000000000E-01 7.1000000000E-01 7.0000000000E-02
|
|
5.9000000000E-01 7.1000000000E-01 6.3000000000E-01
|
|
7.0000000000E-02 6.3000000000E-01 7.1000000000E-01
|
|
xred35 2.6000000000E-01 2.8000000000E-01 3.2000000000E-01
|
|
3.2000000000E-01 2.6000000000E-01 2.8000000000E-01
|
|
9.6000000000E-01 9.4000000000E-01 6.8000000000E-01
|
|
4.0000000000E-02 7.2000000000E-01 9.8000000000E-01
|
|
6.0000000000E-02 4.0000000000E-02 3.2000000000E-01
|
|
2.8000000000E-01 3.2000000000E-01 2.6000000000E-01
|
|
6.8000000000E-01 9.6000000000E-01 9.4000000000E-01
|
|
9.8000000000E-01 4.0000000000E-02 7.2000000000E-01
|
|
3.2000000000E-01 6.0000000000E-02 4.0000000000E-02
|
|
7.4000000000E-01 6.0000000000E-02 2.0000000000E-02
|
|
7.2000000000E-01 7.4000000000E-01 6.8000000000E-01
|
|
2.0000000000E-02 7.4000000000E-01 6.0000000000E-02
|
|
2.8000000000E-01 9.6000000000E-01 2.0000000000E-02
|
|
9.6000000000E-01 2.0000000000E-02 2.8000000000E-01
|
|
9.4000000000E-01 2.6000000000E-01 9.8000000000E-01
|
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9.4000000000E-01 6.8000000000E-01 9.6000000000E-01
|
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7.2000000000E-01 9.8000000000E-01 4.0000000000E-02
|
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4.0000000000E-02 3.2000000000E-01 6.0000000000E-02
|
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6.8000000000E-01 7.2000000000E-01 7.4000000000E-01
|
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6.0000000000E-02 2.0000000000E-02 7.4000000000E-01
|
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2.0000000000E-02 2.8000000000E-01 9.6000000000E-01
|
|
9.8000000000E-01 9.4000000000E-01 2.6000000000E-01
|
|
7.4000000000E-01 6.8000000000E-01 7.2000000000E-01
|
|
2.6000000000E-01 9.8000000000E-01 9.4000000000E-01
|
|
7.4000000000E-01 7.2000000000E-01 6.8000000000E-01
|
|
6.8000000000E-01 7.4000000000E-01 7.2000000000E-01
|
|
4.0000000000E-02 6.0000000000E-02 3.2000000000E-01
|
|
9.6000000000E-01 2.8000000000E-01 2.0000000000E-02
|
|
9.4000000000E-01 9.6000000000E-01 6.8000000000E-01
|
|
7.2000000000E-01 6.8000000000E-01 7.4000000000E-01
|
|
3.2000000000E-01 4.0000000000E-02 6.0000000000E-02
|
|
2.0000000000E-02 9.6000000000E-01 2.8000000000E-01
|
|
6.8000000000E-01 9.4000000000E-01 9.6000000000E-01
|
|
2.6000000000E-01 9.4000000000E-01 9.8000000000E-01
|
|
2.8000000000E-01 2.6000000000E-01 3.2000000000E-01
|
|
9.8000000000E-01 2.6000000000E-01 9.4000000000E-01
|
|
7.2000000000E-01 4.0000000000E-02 9.8000000000E-01
|
|
4.0000000000E-02 9.8000000000E-01 7.2000000000E-01
|
|
6.0000000000E-02 7.4000000000E-01 2.0000000000E-02
|
|
6.0000000000E-02 3.2000000000E-01 4.0000000000E-02
|
|
2.8000000000E-01 2.0000000000E-02 9.6000000000E-01
|
|
9.6000000000E-01 6.8000000000E-01 9.4000000000E-01
|
|
3.2000000000E-01 2.8000000000E-01 2.6000000000E-01
|
|
9.4000000000E-01 9.8000000000E-01 2.6000000000E-01
|
|
9.8000000000E-01 7.2000000000E-01 4.0000000000E-02
|
|
2.0000000000E-02 6.0000000000E-02 7.4000000000E-01
|
|
2.6000000000E-01 3.2000000000E-01 2.8000000000E-01
|
|
7.4000000000E-01 2.0000000000E-02 6.0000000000E-02
|
|
xred36 2.6000000000E-01 2.8000000000E-01 3.2000000000E-01
|
|
3.2000000000E-01 2.6000000000E-01 2.8000000000E-01
|
|
4.6000000000E-01 9.4000000000E-01 1.8000000000E-01
|
|
4.0000000000E-02 2.2000000000E-01 4.8000000000E-01
|
|
5.6000000000E-01 4.0000000000E-02 3.2000000000E-01
|
|
2.8000000000E-01 3.2000000000E-01 2.6000000000E-01
|
|
1.8000000000E-01 4.6000000000E-01 9.4000000000E-01
|
|
4.8000000000E-01 4.0000000000E-02 2.2000000000E-01
|
|
3.2000000000E-01 5.6000000000E-01 4.0000000000E-02
|
|
2.4000000000E-01 5.6000000000E-01 2.0000000000E-02
|
|
2.2000000000E-01 2.4000000000E-01 1.8000000000E-01
|
|
2.0000000000E-02 2.4000000000E-01 5.6000000000E-01
|
|
2.8000000000E-01 4.6000000000E-01 2.0000000000E-02
|
|
4.6000000000E-01 2.0000000000E-02 2.8000000000E-01
|
|
9.4000000000E-01 2.6000000000E-01 4.8000000000E-01
|
|
9.4000000000E-01 1.8000000000E-01 4.6000000000E-01
|
|
2.2000000000E-01 4.8000000000E-01 4.0000000000E-02
|
|
4.0000000000E-02 3.2000000000E-01 5.6000000000E-01
|
|
1.8000000000E-01 2.2000000000E-01 2.4000000000E-01
|
|
5.6000000000E-01 2.0000000000E-02 2.4000000000E-01
|
|
2.0000000000E-02 2.8000000000E-01 4.6000000000E-01
|
|
4.8000000000E-01 9.4000000000E-01 2.6000000000E-01
|
|
2.4000000000E-01 1.8000000000E-01 2.2000000000E-01
|
|
2.6000000000E-01 4.8000000000E-01 9.4000000000E-01
|
|
7.4000000000E-01 7.2000000000E-01 6.8000000000E-01
|
|
6.8000000000E-01 7.4000000000E-01 7.2000000000E-01
|
|
5.4000000000E-01 6.0000000000E-02 8.2000000000E-01
|
|
9.6000000000E-01 7.8000000000E-01 5.2000000000E-01
|
|
4.4000000000E-01 9.6000000000E-01 6.8000000000E-01
|
|
7.2000000000E-01 6.8000000000E-01 7.4000000000E-01
|
|
8.2000000000E-01 5.4000000000E-01 6.0000000000E-02
|
|
5.2000000000E-01 9.6000000000E-01 7.8000000000E-01
|
|
6.8000000000E-01 4.4000000000E-01 9.6000000000E-01
|
|
7.6000000000E-01 4.4000000000E-01 9.8000000000E-01
|
|
7.8000000000E-01 7.6000000000E-01 8.2000000000E-01
|
|
9.8000000000E-01 7.6000000000E-01 4.4000000000E-01
|
|
7.2000000000E-01 5.4000000000E-01 9.8000000000E-01
|
|
5.4000000000E-01 9.8000000000E-01 7.2000000000E-01
|
|
6.0000000000E-02 7.4000000000E-01 5.2000000000E-01
|
|
6.0000000000E-02 8.2000000000E-01 5.4000000000E-01
|
|
7.8000000000E-01 5.2000000000E-01 9.6000000000E-01
|
|
9.6000000000E-01 6.8000000000E-01 4.4000000000E-01
|
|
8.2000000000E-01 7.8000000000E-01 7.6000000000E-01
|
|
4.4000000000E-01 9.8000000000E-01 7.6000000000E-01
|
|
9.8000000000E-01 7.2000000000E-01 5.4000000000E-01
|
|
5.2000000000E-01 6.0000000000E-02 7.4000000000E-01
|
|
7.6000000000E-01 8.2000000000E-01 7.8000000000E-01
|
|
7.4000000000E-01 5.2000000000E-01 6.0000000000E-02
|
|
znucl 1.00000
|
|
|
|
================================================================================
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 1.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 2.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 3.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 4.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 5.
|
|
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|
chkinp: Checking input parameters for consistency, jdtset= 6.
|
|
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|
chkinp: Checking input parameters for consistency, jdtset= 7.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 8.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 9.
|
|
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|
chkinp: Checking input parameters for consistency, jdtset= 10.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 11.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 12.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 13.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 14.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 15.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 16.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 17.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 18.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 19.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 20.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 21.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 22.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 23.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 24.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 25.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 26.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 27.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 28.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 29.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 30.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 31.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 32.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 33.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 34.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 35.
|
|
|
|
chkinp: Checking input parameters for consistency, jdtset= 36.
|
|
|
|
abinit : before driver, prtvol=-1, debugging mode => will skip driver
|
|
|
|
== END DATASET(S) ==============================================================
|
|
================================================================================
|
|
|
|
abinit : before driver, prtvol=-1, debugging mode => will skip outvars
|
|
|
|
|
|
- Timing analysis has been suppressed with timopt=0
|
|
|
|
|
|
|
|
abinit : before driver, prtvol=-1, debugging mode => will skip acknowledgments
|
|
-
|
|
- Proc. 0 individual time (sec): cpu= 1.0 wall= 1.0
|
|
|
|
================================================================================
|
|
|
|
Calculation completed.
|
|
.Delivered 0 WARNINGs and 38 COMMENTs to log file.
|
|
+Overall time at end (sec) : cpu= 1.0 wall= 1.0
|