32
Lattice="7.339792773024719 0.0 0.08987439403474713 4.495143452483346e-16 7.341676691893344 5.504219347663064e-18 -0.09293466260702195 -0.19395849621290862 7.589716429162157" Properties=species:S:1:pos:R:3:forces:R:3 energy=-276.60089548721794 stress="0.00564139495822451 -4.3084899399632986e-05 -6.625501529852845e-07 -4.3084899399632986e-05 0.004190964461912406 0.003525263575632483 -6.625501529852845e-07 0.003525263575632483 0.005673729487984529" dipole="0.00014214991833520077 0.0003069376054022052 9.992871888983965e-05" pbc="T T T"
Mo       0.09495865       1.51276950       5.98350947       0.33008937      -0.33515744       0.48885138
Mo       3.74706066       1.63387455       1.62229575       0.18682445      -0.25829895      -0.56688648
Mo       0.06929842       1.93998852       2.21986361       0.17260437       0.25824725       0.57143005
Mo       3.77193500       1.86713508       5.45012307       0.34203278       0.33486038      -0.48069802
Mo       3.47491612       5.28058613       2.22946671      -0.34194603      -0.33507712       0.48090929
Mo       7.17756271       5.20773269       5.45972629      -0.17275806      -0.25824891      -0.57131062
Mo       3.49980046       5.51384666       6.05729415      -0.18677036       0.25843648       0.56691855
Mo       7.15189247       5.63495171       1.69608031      -0.32999517       0.33494934      -0.48890815
O        0.36830478      -0.01756811       1.46977960      -0.25182592      -0.52536527       0.12477322
O        3.97719580      -0.11274427       6.15207172      -0.19092401      -0.47515805      -0.07884639
O        1.80794955       1.23416230       5.50551675      -0.47926398       0.18089837       0.15375577
O        3.98109196       1.34854820       3.78388245      -0.07987127       0.27774705       0.70075343
O        7.00776786       1.35531724       3.91953970       0.20578536       0.27789107      -0.65537608
O        5.53963097       1.47953244       1.56218875      -0.50001946       0.10790793       0.07947772
O        1.85984937       2.09433050       2.32385525      -0.49758931      -0.10794731      -0.09179172
O        3.29234353       2.02457734       7.59286626       0.18964443      -0.27781170       0.66017279
O        0.35618806       2.22531487       0.06465549      -0.06267597      -0.27776792      -0.70252514
O        5.47270819       2.14573228       5.96991656      -0.47525460      -0.18084518      -0.16541251
O        0.31734579       3.49264885       5.28679729      -0.19279230       0.47502395       0.07415308
O        4.02762097       3.59142132       2.37946631      -0.24881181       0.52560352      -0.13088072
O        3.21924015       3.55628989       5.30012346       0.24870448      -0.52531603       0.13087115
O        6.92951533       3.65507236       2.39279261       0.19278450      -0.47510460      -0.07413452
O        1.77415293       5.00197893       1.70967321       0.47526998       0.18089084       0.16541846
O        6.89067306       4.92240634       7.61493441       0.06265232       0.27772590       0.70250751
O        3.95451759       5.12314387       0.08672364      -0.18965253       0.27778801      -0.66006968
O        5.38700163       5.05339057       5.35574452       0.49784010       0.10790085       0.09170770
O        1.70723003       5.66818863       6.11741114       0.49989911      -0.10794771      -0.07955513
O        0.23909326       5.79239397       3.76005007      -0.20578049      -0.27782929       0.65530397
O        3.26575904       5.79917287       3.89571733       0.07991430      -0.27783168      -0.70108121
O        5.43891157       5.91354891       2.17407301       0.47906090      -0.18082275      -0.15369279
O        3.26966532       7.26046548       1.52751818       0.19089745       0.47506342       0.07888710
O        6.87854647       7.16527945       6.20980004       0.25192651       0.52559804      -0.12472245