mirror of https://github.com/abinit/abinit.git
409 lines
10 KiB
Plaintext
409 lines
10 KiB
Plaintext
BoltzTraP eigen-energies file generated by ABINIT. ispin = 1
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29 1 0.5665905457E+00 ! nk, nspin, Fermi level(Ry) : energies below in Ry
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0.0000000000E+00 0.0000000000E+00 0.0000000000E+00 13 ! kpt nband
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-0.2536065003E+00
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0.1505095338E+01
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0.1505095338E+01
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0.1505095338E+01
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0.1562517299E+01
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0.1562517299E+01
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0.1562517299E+01
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0.1783096734E+01
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0.2003046699E+01
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0.2003046699E+01
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0.2148919196E+01
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0.2357768581E+01
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0.2357768582E+01
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0.1250000000E+00 0.0000000000E+00 0.0000000000E+00 13 ! kpt nband
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-0.2225669584E+00
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0.1171149070E+01
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0.1415611612E+01
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0.1415611612E+01
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0.1628504890E+01
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0.1690610527E+01
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0.1690610527E+01
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0.1870309594E+01
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0.1870309594E+01
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0.2026869629E+01
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0.2087702695E+01
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0.2425187024E+01
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0.2561171271E+01
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0.2500000000E+00 0.0000000000E+00 0.0000000000E+00 13 ! kpt nband
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-0.1297799580E+00
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0.8139450436E+00
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0.1355343146E+01
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0.1355343146E+01
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0.1605812946E+01
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0.1640339792E+01
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0.1640339792E+01
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0.1927195986E+01
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0.1943961638E+01
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0.1943961638E+01
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0.2343018938E+01
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0.2751384140E+01
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0.2931421672E+01
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0.3750000000E+00 0.0000000000E+00 0.0000000000E+00 13 ! kpt nband
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0.2305089134E-01
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0.4987059517E+00
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0.1346660173E+01
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0.1346660173E+01
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0.1496332637E+01
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0.1496332637E+01
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0.1612441303E+01
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0.1777712402E+01
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0.2201257158E+01
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0.2201257158E+01
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0.2620674284E+01
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0.3034365591E+01
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0.3034365642E+01
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0.5000000000E+00 0.0000000000E+00 0.0000000000E+00 13 ! kpt nband
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0.2273078068E+00
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0.2400046931E+00
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0.1374260283E+01
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0.1374260283E+01
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0.1416015384E+01
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0.1416015384E+01
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0.1657410979E+01
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0.1680942103E+01
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0.2393666869E+01
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0.2393666869E+01
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0.2796182179E+01
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0.2796182179E+01
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0.2817486076E+01
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0.1250000000E+00 0.1250000000E+00 0.0000000000E+00 13 ! kpt nband
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-0.2122222921E+00
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0.1282794183E+01
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0.1282794183E+01
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0.1321755508E+01
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0.1478653031E+01
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0.1643037744E+01
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0.1837782453E+01
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0.1837782453E+01
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0.2038922959E+01
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0.2047998859E+01
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0.2253772876E+01
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0.2410166343E+01
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0.2410166343E+01
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0.2500000000E+00 0.1250000000E+00 0.0000000000E+00 13 ! kpt nband
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-0.1401195987E+00
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0.9503109070E+00
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0.1203386795E+01
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0.1323077143E+01
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0.1404927203E+01
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0.1586006089E+01
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0.1874731348E+01
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0.1890095847E+01
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0.2074291954E+01
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0.2159177524E+01
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0.2356847459E+01
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0.2651095663E+01
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0.2652914122E+01
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0.3750000000E+00 0.1250000000E+00 0.0000000000E+00 13 ! kpt nband
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-0.7421104840E-02
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0.6230839861E+00
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0.1177392912E+01
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0.1234214007E+01
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0.1307091405E+01
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0.1748712343E+01
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0.1790448325E+01
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0.1898766481E+01
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0.2013224436E+01
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0.2300141433E+01
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0.2648485994E+01
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0.2970589510E+01
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0.3061187414E+01
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0.5000000000E+00 0.1250000000E+00 0.0000000000E+00 13 ! kpt nband
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0.1833604569E+00
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0.3423396080E+00
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0.1114614191E+01
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0.1204369483E+01
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0.1338823320E+01
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0.1637069382E+01
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0.1820354130E+01
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0.1938722008E+01
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0.2145235127E+01
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0.2401915140E+01
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0.2798519508E+01
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0.2836306364E+01
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0.2921058439E+01
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-0.3750000000E+00 0.1250000000E+00 0.0000000000E+00 13 ! kpt nband
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0.1135678772E+00
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0.4298767909E+00
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0.1049853489E+01
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0.1283870637E+01
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0.1425086842E+01
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0.1576357367E+01
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0.1770083678E+01
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0.1999220133E+01
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0.2141522769E+01
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0.2283488838E+01
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0.2680692460E+01
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0.2900908917E+01
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0.3114238801E+01
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-0.2500000000E+00 0.1250000000E+00 0.0000000000E+00 13 ! kpt nband
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-0.5828188281E-01
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0.7258245680E+00
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0.1042148800E+01
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0.1412676619E+01
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0.1562231522E+01
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0.1570231193E+01
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0.1744124625E+01
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0.1858941518E+01
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0.2017585854E+01
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0.2180922007E+01
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0.2572113412E+01
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0.2822975326E+01
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0.2929301893E+01
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-0.1250000000E+00 0.1250000000E+00 0.0000000000E+00 13 ! kpt nband
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-0.1709030555E+00
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0.1036764745E+01
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0.1118665348E+01
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0.1562001445E+01
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0.1585327156E+01
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0.1693018498E+01
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0.1715332446E+01
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0.1737664182E+01
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0.1854901978E+01
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0.2257729909E+01
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0.2260994932E+01
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0.2496302176E+01
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0.2586947906E+01
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0.2500000000E+00 0.2500000000E+00 0.0000000000E+00 13 ! kpt nband
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-0.8891494027E-01
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0.1105556361E+01
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0.1105556361E+01
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0.1125365965E+01
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0.1164990362E+01
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0.1347456549E+01
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0.2151559524E+01
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0.2152470743E+01
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0.2152470743E+01
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0.2493296714E+01
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0.2509654783E+01
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0.2595868932E+01
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0.2595868932E+01
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0.3750000000E+00 0.2500000000E+00 0.0000000000E+00 13 ! kpt nband
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0.2281075255E-01
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0.7987666920E+00
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0.9691825593E+00
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0.1061478675E+01
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0.1178277557E+01
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0.1456910009E+01
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0.2046028968E+01
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0.2190850176E+01
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0.2393371073E+01
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0.2410958635E+01
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0.2783522537E+01
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0.2869968950E+01
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0.2941188666E+01
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0.5000000000E+00 0.2500000000E+00 0.0000000000E+00 13 ! kpt nband
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0.1928648955E+00
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0.5068839997E+00
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0.8281062237E+00
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0.1070608513E+01
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0.1201371751E+01
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0.1728029581E+01
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0.1928569385E+01
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0.2123213530E+01
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0.2369333121E+01
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0.2434237628E+01
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0.2830087954E+01
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0.2939179770E+01
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0.3067444996E+01
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-0.3750000000E+00 0.2500000000E+00 0.0000000000E+00 13 ! kpt nband
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0.2625124170E+00
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0.4172416699E+00
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0.7454170618E+00
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0.1132859103E+01
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0.1272759354E+01
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0.1852763933E+01
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0.1980013449E+01
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0.2082449582E+01
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0.2133622445E+01
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0.2358101866E+01
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0.2610220271E+01
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0.3036936787E+01
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0.3222427929E+01
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-0.2500000000E+00 0.2500000000E+00 0.0000000000E+00 13 ! kpt nband
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0.7334661910E-01
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0.6545134642E+00
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0.7593639902E+00
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0.1248286866E+01
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0.1397382378E+01
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0.1817992043E+01
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0.1836821578E+01
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0.1922162628E+01
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0.2094671960E+01
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0.2429012755E+01
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0.2596655427E+01
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0.2750124047E+01
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0.3129649863E+01
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0.3750000000E+00 0.3750000000E+00 0.0000000000E+00 13 ! kpt nband
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0.1130088332E+00
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0.7507780777E+00
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0.9993312912E+00
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0.9993312913E+00
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0.1003629814E+01
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0.1245655271E+01
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0.2312815133E+01
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0.2410767835E+01
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0.2410767835E+01
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0.2788764732E+01
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0.2932545183E+01
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0.2932545183E+01
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0.2991924637E+01
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0.5000000000E+00 0.3750000000E+00 0.0000000000E+00 13 ! kpt nband
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0.2598954699E+00
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0.5891350583E+00
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0.7238339765E+00
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0.9906318161E+00
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0.1101168770E+01
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0.1389014826E+01
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0.2251447605E+01
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0.2395826805E+01
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0.2475932506E+01
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0.2774402079E+01
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0.2957704347E+01
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0.2985740939E+01
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0.3146231677E+01
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-0.3750000000E+00 0.3750000000E+00 0.0000000000E+00 13 ! kpt nband
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0.4249516865E+00
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0.4643775791E+00
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0.5293112984E+00
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0.1035306343E+01
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0.1164172878E+01
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0.1699645139E+01
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0.2152196318E+01
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0.2199940779E+01
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0.2252540584E+01
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0.2567156433E+01
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0.2962937291E+01
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0.2973665560E+01
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0.3249784908E+01
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0.5000000000E+00 0.5000000000E+00 0.0000000000E+00 13 ! kpt nband
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0.3485688461E+00
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0.4443087462E+00
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0.9621710500E+00
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0.9640639159E+00
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0.9640639159E+00
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0.1211250070E+01
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0.2433171852E+01
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0.2551522607E+01
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0.2551522607E+01
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0.2937175039E+01
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0.2937175039E+01
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0.2957760841E+01
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0.2983421160E+01
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0.3750000000E+00 0.2500000000E+00 0.1250000000E+00 13 ! kpt nband
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-0.4807866079E-01
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0.8462711243E+00
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0.9412760154E+00
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0.1199646435E+01
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0.1456906060E+01
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0.1561384248E+01
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0.1801614183E+01
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0.2040706370E+01
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0.2153883827E+01
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0.2396100688E+01
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0.2490813107E+01
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0.2828131885E+01
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0.2844214418E+01
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0.5000000000E+00 0.2500000000E+00 0.1250000000E+00 13 ! kpt nband
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0.1033905859E+00
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0.5721015992E+00
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0.8947078389E+00
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0.1043196192E+01
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0.1493287291E+01
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0.1644604849E+01
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0.1796624004E+01
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0.2084950673E+01
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0.2281726774E+01
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0.2333932901E+01
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0.2690087759E+01
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0.2898264331E+01
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0.3082751877E+01
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-0.3750000000E+00 0.2500000000E+00 0.1250000000E+00 13 ! kpt nband
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0.3043467166E+00
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0.3196021249E+00
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0.9292152844E+00
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0.9509245843E+00
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0.1524400928E+01
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0.1571566046E+01
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0.2031151742E+01
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0.2066769833E+01
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0.2243060794E+01
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0.2246888903E+01
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0.2776675067E+01
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0.2875149535E+01
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0.3217653980E+01
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0.5000000000E+00 0.3750000000E+00 0.1250000000E+00 13 ! kpt nband
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0.1529838741E+00
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0.7314948131E+00
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0.7836405978E+00
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0.8368620018E+00
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0.1345513943E+01
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0.1470829561E+01
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0.1972588239E+01
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0.2384641948E+01
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0.2388899163E+01
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0.2642095327E+01
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0.2806818097E+01
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0.2845786491E+01
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0.3113474464E+01
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-0.3750000000E+00 0.3750000000E+00 0.1250000000E+00 13 ! kpt nband
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0.3382712609E+00
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0.4944724311E+00
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0.6678025579E+00
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0.8223487814E+00
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0.1426372666E+01
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0.1718900344E+01
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0.1870091379E+01
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0.2134781304E+01
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0.2417790435E+01
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0.2652205121E+01
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0.2866319611E+01
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0.2988212092E+01
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0.3174803746E+01
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-0.2500000000E+00 0.3750000000E+00 0.1250000000E+00 13 ! kpt nband
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0.2721011501E+00
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0.5398285680E+00
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0.6434139533E+00
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0.9039389566E+00
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0.1512202380E+01
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0.1760998999E+01
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0.1830368329E+01
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0.2077590363E+01
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0.2310414938E+01
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0.2540877533E+01
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0.2814510338E+01
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0.2815960229E+01
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0.3251510351E+01
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-0.3750000000E+00 0.5000000000E+00 0.1250000000E+00 13 ! kpt nband
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0.3866761264E+00
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0.4835870914E+00
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0.6935893463E+00
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0.7948160120E+00
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0.1308089253E+01
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0.1438800921E+01
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0.2197151092E+01
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0.2217501191E+01
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0.2563851622E+01
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0.2885990159E+01
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0.2965144544E+01
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0.3004750714E+01
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0.3151739366E+01
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-0.2500000000E+00 0.5000000000E+00 0.2500000000E+00 13 ! kpt nband
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0.5014091545E+00
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0.5014091545E+00
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0.5785318778E+00
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0.6310745987E+00
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0.1723990283E+01
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0.1723990283E+01
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0.1735173033E+01
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0.1893966730E+01
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0.2570648699E+01
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0.2922231581E+01
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0.3034165592E+01
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0.3034165592E+01
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0.3047756023E+01
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