mirror of https://github.com/abinit/abinit.git
462 lines
56 KiB
Plaintext
462 lines
56 KiB
Plaintext
# ABINIT generated phonon angular momentum, along points in PHFRQ file. All in Ha atomic units
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#
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# angular momentum in cartesian coordinates
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# number_of_qpoints 151
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# number_of_phonon_modes 6
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#
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1 0.0000000000E+00 0.0000000000E+00 0.0000000000E+00 0.0000000000E+00 0.0000000000E+00 0.0000000000E+00
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2 0.2537167032E-13 0.1794093108E-01 -0.1796563194E-01 -0.1734730793E-03 0.1095446408E-13 0.1981739388E-03
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3 0.5789075700E-15 0.3574447747E-01 -0.3594110538E-01 -0.1367394598E-02 0.3036526180E-14 0.1564022512E-02
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4 0.9264166236E-15 0.5325343796E-01 -0.5391150883E-01 -0.4509842986E-02 0.2726415352E-14 0.5167913862E-02
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5 -0.1128845309E-13 0.7031406663E-01 -0.7185634139E-01 -0.1038071430E-01 -0.3151460749E-14 0.1192298905E-01
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6 -0.5781955206E-15 0.8676391611E-01 -0.8973493540E-01 -0.1961054583E-01 -0.1869243919E-14 0.2258156512E-01
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7 -0.5946806747E-15 0.1024343926E+00 -0.1074891665E+00 -0.3272886075E-01 0.9488626882E-15 0.3778363462E-01
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8 -0.3955367609E-14 0.1171567436E+00 -0.1250530100E+00 -0.5024302849E-01 -0.2027019498E-14 0.5813929489E-01
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9 -0.3242634405E-15 0.1307732467E+00 -0.1423713079E+00 -0.7272753557E-01 -0.1306684501E-14 0.8432559682E-01
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10 0.1766039313E-14 0.1431543246E+00 -0.1594285015E+00 -0.1009091044E+00 0.2590608020E-14 0.1171832812E+00
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11 -0.1507039782E-14 0.1542211047E+00 -0.1762859262E+00 -0.1357352742E+00 -0.4609478667E-14 0.1578000956E+00
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12 -0.4275682027E-15 0.1639710085E+00 -0.1931230827E+00 -0.1783995519E+00 0.3422355585E-13 0.2075516261E+00
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13 0.1639140083E-14 0.1725014627E+00 -0.2102745334E+00 -0.1834948364E-13 -0.2302384855E+00 0.2680115561E+00
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14 -0.2164958946E-16 0.1800245433E+00 -0.2282509072E+00 0.9850646907E-14 -0.2922531661E+00 0.3404795300E+00
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15 0.5995683629E-15 0.1868647481E+00 -0.2477316763E+00 0.3517537670E-14 -0.3636367360E+00 0.4245036642E+00
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16 0.1129485574E-14 0.1934347941E+00 -0.2695205484E+00 -0.2470475548E-14 -0.4382289909E+00 0.5143147452E+00
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17 0.1549831922E-15 0.2001908457E+00 -0.2944617378E+00 0.1371091786E-14 -0.4990598648E+00 0.5933307569E+00
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18 0.3183231053E-15 0.2075767781E+00 -0.3233246799E+00 0.2550248842E-14 -0.5187783943E+00 0.6345262961E+00
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19 -0.1491193463E-15 0.2159721419E+00 -0.3566713464E+00 -0.2641931928E-14 -0.4789907812E+00 0.6196899857E+00
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20 0.8141601474E-16 0.2256555258E+00 -0.3947202130E+00 -0.3901900971E+00 0.6531405342E-14 0.5592547843E+00
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21 0.1197250191E-15 0.2367828039E+00 -0.4372143088E+00 -0.2784761251E+00 0.8410625228E-16 0.4789076300E+00
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22 -0.3819633999E-15 0.2493624535E+00 -0.4832930480E+00 -0.1634854324E+00 -0.2104994076E-15 0.3974160269E+00
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23 -0.4148391047E-15 0.2631955921E+00 -0.5313663723E+00 -0.5459832475E-01 0.4749061511E-15 0.3227691050E+00
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24 0.7336629198E-16 0.2777464477E+00 -0.5790009445E+00 0.4419408244E-01 -0.8509113730E-15 0.2570604143E+00
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25 0.6593235430E-15 0.2919340165E+00 -0.6228553102E+00 0.1305901994E+00 0.1482457501E-14 0.2003310942E+00
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26 0.4497172304E-15 0.3039106202E+00 -0.6587504894E+00 0.2025914177E+00 -0.8039314843E-16 0.1522484516E+00
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27 -0.4213708400E-15 0.3110314124E+00 -0.6820387383E+00 0.2583900197E+00 0.6518971895E-15 0.1126173063E+00
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28 -0.4521208292E-15 0.3103391356E+00 -0.6884769195E+00 0.2967466472E+00 0.2135423090E-15 0.8139113673E-01
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29 0.6120693970E-17 0.2997114778E+00 -0.6756010515E+00 0.3174399925E+00 -0.5338907836E-16 0.5844958124E-01
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30 -0.3256828601E-15 0.2791325370E+00 -0.6439704213E+00 0.3215732789E+00 0.1894819233E-15 0.4326460549E-01
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31 0.3580138891E-15 0.2509868753E+00 -0.5972079010E+00 0.3115948784E+00 -0.4473508814E-16 0.3462614722E-01
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32 -0.6508061912E-15 0.2189517250E+00 -0.5405367859E+00 0.2909218388E+00 -0.1486164794E-15 0.3066322211E-01
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33 0.7539879479E-16 0.1864181220E+00 -0.4788806614E+00 0.2632172574E+00 0.2183720598E-15 0.2924528200E-01
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34 0.9894303316E-15 0.1555754970E+00 -0.4157395247E+00 0.2316359606E+00 0.3382310245E-15 0.2852806713E-01
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35 -0.1885082496E-15 0.1273688142E+00 -0.3530619771E+00 0.1983955209E+00 0.7187797254E-15 0.2729764204E-01
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36 -0.5004517285E-15 0.1018886969E+00 -0.2916434405E+00 0.1647649611E+00 -0.3580893784E-16 0.2498978247E-01
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37 -0.7234314449E-15 0.7878573387E-01 -0.2316002083E+00 0.1313065894E+00 0.4512532975E-15 0.2150788504E-01
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38 -0.3198362631E-15 0.5755038039E-01 -0.1727258732E+00 0.9816655368E-01 0.8626766983E-15 0.1700893917E-01
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39 0.6611456459E-15 0.3765757684E-01 -0.1147061328E+00 0.6530079437E-01 0.3475222422E-15 0.1174776154E-01
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40 0.7983025943E-15 0.1862130878E-01 -0.5722502529E-01 0.3261017560E-01 -0.2764757517E-14 0.5993540910E-02
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41 -0.2540555155E-33 -0.1647015687E-35 0.0000000000E+00 -0.4227694663E-17 0.2468087211E-49 0.4227694663E-17
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42 0.1655457991E-17 -0.1376919862E-17 0.8455255758E-19 0.4931873819E-17 -0.5179664069E-17 -0.1153004268E-18
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43 -0.2368104604E-22 0.1570755661E-22 -0.6471497522E-26 0.2235815875E-22 -0.1444734085E-22 -0.1118208371E-23
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44 -0.5008068107E-17 -0.1765974980E-16 0.2044844531E-16 0.1222379446E-15 -0.9403639390E-16 -0.2598217811E-16
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45 0.2994447456E-16 -0.1234663535E-17 -0.2502025074E-16 -0.2302000768E-24 -0.3365604992E-16 0.2996648982E-16
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46 0.2308027072E-16 0.7512252343E-17 -0.3017246893E-16 -0.6503754782E-24 -0.3402749189E-16 0.3360743823E-16
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47 -0.6238463082E-16 0.1229397177E-16 0.2830694691E-16 0.5077429631E-16 0.2852430909E-26 -0.2899058421E-16
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48 0.1525717270E-16 -0.3827974022E-17 -0.9930121761E-17 0.1089709185E-16 -0.2166100332E-16 0.9264835301E-17
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49 0.8309160291E-24 -0.1789079222E-16 -0.3856316136E-17 0.1832360650E-23 0.1849308038E-16 0.3254025981E-17
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50 0.6879138769E-16 -0.6879138892E-16 0.0000000000E+00 0.8894266125E-17 -0.8894265685E-17 0.0000000000E+00
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51 0.3306600682E-16 0.6946329006E-16 -0.9470112012E-16 -0.6002830210E-24 -0.7220576326E-16 0.6437758687E-16
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52 0.6943584555E-16 0.1046724971E-15 -0.1749922549E-15 -0.1053298353E-15 -0.4891310009E-23 0.1062137527E-15
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53 0.2234885316E-15 0.1993323041E-15 -0.3891118522E-15 -0.2507047799E-15 0.6693567979E-17 0.2103022284E-15
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54 0.1513500647E-15 0.7890073337E-17 -0.1870433208E-15 0.6099622301E-16 -0.1229626223E-15 0.8976958202E-16
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55 0.6878367804E-33 -0.1610459746E-32 0.7257316269E-33 -0.2077429993E-32 -0.1349504720E-32 0.3660858078E-32
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56 0.2946403124E-15 -0.5847367520E-17 -0.2602779126E-15 -0.1259267963E-15 0.9101302538E-25 0.9741176395E-16
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57 -0.1353481736E-15 0.9877581112E-16 -0.3431667105E-17 0.3887958623E-16 0.3106390963E-24 0.1124443011E-17
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58 -0.5214243063E-25 -0.5706965473E-24 0.2387228515E-24 -0.6384377033E-24 -0.1410278538E-24 0.9482312285E-24
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59 -0.2372481867E-16 -0.5682252877E-16 0.2513588146E-24 0.8054734600E-16 0.1141843683E-24 0.9377100696E-24
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60 -0.4371649950E-15 -0.2688745681E-15 0.6575319057E-15 0.1835163047E-15 0.1001505615E-24 -0.1350086470E-15
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61 -0.4229555719E-15 -0.2124937223E-15 0.6629019098E-15 0.1115677194E-15 -0.2693508506E-16 -0.1120852500E-15
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62 0.2864781324E-16 -0.3293913070E-15 0.2580243174E-15 -0.4434009637E-32 0.7754618366E-16 -0.3482700731E-16
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63 -0.1480464129E-14 0.1246842061E-16 0.1466548150E-14 0.1529087337E-15 0.4122561023E-32 -0.1514611759E-15
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64 0.1141136120E-14 -0.1589825993E-16 -0.1068390432E-14 -0.6471799155E-16 -0.7171282069E-16 0.7958338459E-16
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65 0.4298242706E-16 0.5568423058E-15 -0.5997060731E-15 -0.3986131974E-16 0.1017696856E-16 0.2956569144E-16
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66 0.1382135882E-15 -0.2108976522E-15 0.5667258313E-16 0.5905624713E-32 0.1762741385E-16 -0.1615932991E-17
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67 -0.5513870508E-14 -0.9068094727E-16 0.5604481366E-14 0.5540713028E-16 0.1718119515E-16 -0.7251823578E-16
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68 -0.3609608626E-16 0.4344226857E-14 -0.4324388287E-14 -0.6364048607E-18 0.2723735434E-17 0.1417018552E-16
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69 0.5973174215E-34 -0.7411243621E-34 0.1438069406E-34 -0.1983870152E-49 -0.1658621929E-33 0.1658621929E-33
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70 0.3662383633E-01 -0.3662383633E-01 -0.1411833531E-13 -0.5115185949E-02 0.5115185949E-02 0.1968729614E-15
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71 -0.3905192088E-02 0.3905192088E-02 0.4887910471E-14 0.1099304514E-01 -0.1099304514E-01 0.2370559241E-15
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72 -0.3863074025E-01 0.3863074025E-01 -0.3361805803E-14 0.4600676428E-01 -0.4600676428E-01 -0.9923125818E-16
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73 0.1697665618E+00 -0.1697665618E+00 0.1706550732E-15 0.4292114484E-02 -0.4292114484E-02 -0.3438099711E-15
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74 -0.1546823891E-01 0.1546823891E-01 -0.2008190669E-15 -0.6933698832E-02 0.6933698832E-02 0.1690581244E-15
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75 0.3399775017E+00 -0.3399775017E+00 0.1590405759E-16 0.1560194201E+00 -0.1560194201E+00 0.5108993714E-15
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76 0.6373475288E-01 -0.6373475288E-01 0.7676357388E-15 0.8309132805E-01 -0.8309132805E-01 0.7694577326E-15
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77 0.1113159809E+00 -0.1113159809E+00 -0.4866796589E-15 0.4200314356E-02 -0.4200314356E-02 0.6670145180E-15
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78 -0.2411293892E-01 0.2411293892E-01 -0.4690009397E-15 0.5370875805E-16 0.1154606928E-14 -0.1428629991E-14
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79 -0.3196904789E+00 0.3196904789E+00 -0.3385198832E-15 0.9944972814E-15 0.1529697242E-16 -0.1323047238E-14
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80 -0.1666489121E-01 0.1666489121E-01 -0.4632389575E-15 -0.1801903901E-15 0.3409333777E-16 0.3706081010E-16
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81 -0.5913715822E-01 0.5913715822E-01 0.2600624735E-15 0.4206731125E+00 -0.4206731125E+00 -0.3577236106E-15
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82 -0.7254273662E-01 0.7254273662E-01 -0.1491901463E-15 -0.2225930026E+00 0.2225930026E+00 0.2202347562E-15
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83 -0.3700340068E-01 0.3700340068E-01 -0.2848800845E-15 -0.5129221010E-01 0.5129221010E-01 0.8617738839E-16
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84 -0.1544546870E+00 0.1544546870E+00 -0.4609176187E-15 0.5495589460E-15 -0.6713230494E-15 0.5718680631E-15
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85 0.1363490941E-01 -0.1363490941E-01 0.3906517539E-15 0.1614353938E+00 -0.1614353938E+00 -0.6011701776E-16
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86 0.5958084847E-01 -0.5958084847E-01 0.2070910253E-15 0.2117969434E+00 -0.2117969434E+00 0.4279718683E-15
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87 0.8978515029E-02 -0.8978515029E-02 0.2647614517E-16 0.3472053753E-01 -0.3472053753E-01 0.2648537925E-14
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88 0.7146714861E-01 -0.7146714861E-01 0.3641923855E-16 -0.1177290760E+00 0.1177290760E+00 -0.9012871559E-16
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89 -0.3932812572E-02 0.3932812572E-02 -0.8286124512E-16 0.4500039787E-15 -0.1631690275E-14 0.1353348064E-14
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90 -0.4885605938E-01 0.4885605938E-01 -0.1792043313E-16 -0.1569312514E+00 0.1569312514E+00 0.4281900152E-15
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91 0.4565728978E-01 -0.4565728978E-01 0.4402587454E-16 -0.1068495452E+00 0.1068495452E+00 -0.3129769678E-15
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92 -0.2069582657E-03 0.2069582657E-03 -0.1462354278E-16 -0.3208357015E-01 0.3208357015E-01 0.9817973135E-16
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93 0.4840640664E-17 -0.4840640664E-17 -0.5123754509E-32 0.9243959802E-32 0.6759513309E-32 -0.1410063670E-31
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94 0.5133074621E-14 0.8538676083E-02 -0.3645589350E-01 0.8131423876E-14 -0.3057038034E-01 0.5848759775E-01
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95 0.1140486085E-14 0.1752550337E-01 -0.7307992802E-01 -0.2981154332E-13 -0.6332148647E-01 0.1188759111E+00
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96 -0.3185210745E-14 0.2744546204E-01 -0.1100580964E+00 -0.1826162943E-13 -0.1001775270E+00 0.1827901614E+00
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97 -0.2830936283E-14 0.3885607858E-01 -0.1476143276E+00 -0.2640444982E-14 -0.1415610865E+00 0.2503193355E+00
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98 0.2766687697E-14 0.5241696744E-01 -0.1860309569E+00 -0.2822067219E-14 -0.1822395140E+00 0.3158535035E+00
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99 0.1148299975E-14 0.6889702043E-01 -0.2256562199E+00 -0.5453683785E-14 -0.2044430965E+00 0.3612022959E+00
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100 0.2172611767E-15 0.8911678073E-01 -0.2668580855E+00 -0.5444746608E-14 -0.1855322759E+00 0.3632735807E+00
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101 -0.3121480010E-15 0.1137286589E+00 -0.3098267559E+00 0.1281702082E-14 -0.1299341520E+00 0.3260322490E+00
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102 -0.7755267319E-15 0.1426523596E+00 -0.3540396495E+00 -0.2715014199E-14 -0.6422946509E-01 0.2756167550E+00
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103 0.3686036470E-15 0.1739739681E+00 -0.3971905641E+00 -0.3982720200E-14 -0.5271640442E-02 0.2284882364E+00
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104 0.9566683551E-16 0.2026398156E+00 -0.4339064297E+00 0.9353316589E-14 0.4264151903E-01 0.1886250951E+00
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105 -0.2803931560E-14 0.2208538538E+00 -0.4561557315E+00 0.7984912057E-01 0.5314844005E-14 0.1554527570E+00
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106 -0.2179732407E-14 0.2224809614E+00 -0.4576524250E+00 0.1075012011E+00 -0.5546839445E-14 0.1276702624E+00
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107 -0.5155281404E-15 0.2081704102E+00 -0.4389760924E+00 0.1265877644E+00 0.6814364847E-14 0.1042179178E+00
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108 -0.7697782223E-15 0.1842094419E+00 -0.4064252180E+00 0.1378588177E+00 0.1134588308E-13 0.8435695839E-01
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109 -0.1308912389E-15 0.1571354383E+00 -0.3666346058E+00 0.1419339802E+00 0.7444660362E-14 0.6756518732E-01
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110 -0.1361131271E-14 0.1308366974E+00 -0.3236838610E+00 0.1394130338E+00 -0.2809084645E-14 0.5343412982E-01
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111 0.5158266246E-15 0.1068098977E+00 -0.2793589731E+00 0.1309456167E+00 -0.1250317707E-15 0.4160345875E-01
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112 0.9024006436E-15 0.8524663876E-01 -0.2342344290E+00 0.1172588948E+00 -0.2686145469E-14 0.3172889538E-01
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113 -0.1909956476E-14 0.6581024080E-01 -0.1884358164E+00 0.9915431000E-01 -0.1060328540E-13 0.2347126562E-01
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114 0.2726710144E-14 0.4801932561E-01 -0.1420022442E+00 0.7748739935E-01 -0.1397395473E-13 0.1649551921E-01
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115 -0.2054028915E-14 0.3139847411E-01 -0.9501414402E-01 0.5314323475E-01 -0.8595898901E-14 0.1047243516E-01
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116 0.5810552583E-14 0.1551985309E-01 -0.4761576456E-01 0.2701640672E-01 0.6671341176E-14 0.5079504759E-02
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117 0.0000000000E+00 0.0000000000E+00 0.0000000000E+00 0.0000000000E+00 0.0000000000E+00 0.0000000000E+00
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118 0.4227002123E-01 -0.1569070918E-01 -0.8165060581E-01 0.7096369907E-02 0.3938058458E-01 0.8594339270E-02
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119 0.8516073859E-01 -0.3154665734E-01 -0.1630788463E+00 0.1450777979E-01 0.7791810769E-01 0.1703887755E-01
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120 0.1293080053E+00 -0.4771882390E-01 -0.2441432903E+00 0.2256367931E-01 0.1148352850E+00 0.2515514459E-01
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