64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-99.62243086161398 stress="0.0006486688119388698 0.0002875656635803596 0.00014466104513758904 0.0002875656635803596 0.0005151994525139747 0.00015056966245670367 0.00014466104513758904 0.00015056966245670367 0.0006751295772001254" free_energy=-99.62243086161398 pbc="F F F" C 34.75900849 35.18525799 35.18408192 5.59634195 2.26121312 2.44817657 C 36.59933616 35.93572417 35.98055861 -4.00912644 2.58203586 -5.80017391 C 37.14715992 37.22516294 35.23402360 5.96213525 5.38846176 7.28816490 C 38.38021302 38.78131475 35.96390753 -10.77918939 -3.07933554 5.03048346 C 37.29465675 34.93158033 37.83765651 8.51888153 3.96178486 4.18113361 C 38.85840215 35.76443239 38.52583685 -6.31731200 -7.18276783 2.45976205 C 34.64739407 38.29713884 37.56715001 -0.36640105 -0.24032010 -0.31430766 C 36.55604684 39.07636534 38.99475015 0.24779884 21.85725097 -12.00277260 C 40.43580477 35.40181549 34.78706435 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35.30609528 42.83814538 37.63905551 2.02786912 3.17555849 5.44579816 C 35.90975672 43.66349090 39.11824152 -2.46118472 -2.66770373 -5.43664815 C 40.80025774 40.54371647 35.11722067 2.36673030 2.19939393 4.11348317 C 41.60365422 41.12475624 36.46651109 0.52398822 -6.29660834 -1.77757825 C 42.56887234 43.28829204 35.43479524 3.94517826 -0.37905432 3.70049990 C 43.72991215 43.09524421 36.59344261 -3.74710777 0.81943735 -3.91953043 C 42.58087455 40.09122498 37.35935114 7.00530081 11.24657231 6.27575410 C 43.97769358 41.09133389 38.54532507 -9.77881985 -7.50677094 -8.43239989 C 39.66448343 42.68403127 37.11226018 -2.94801175 1.87092238 -2.39911660 C 40.97555741 43.41566944 38.89352680 4.59275325 -1.61561567 2.91452555 C 35.05615299 35.04331559 39.53882749 8.63668060 8.14527884 10.12397486 C 36.18959060 36.09305905 40.84266193 -1.93380760 -17.44929338 1.92002895 C 36.55943280 38.13961255 39.73157267 0.58655308 -9.82178815 7.10428470 C 38.55150311 38.51894432 41.34725891 4.25248897 4.95771090 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10.88391671 5.69713415 -9.19764865 C 37.82350393 42.21827495 39.80335328 -8.50447943 -2.21725301 12.95593354 C 38.63834321 43.28337470 40.87827378 -2.56493807 -2.84651737 -3.59701150 C 37.36102597 39.94186987 42.87644269 -3.82616912 -3.08021800 2.85409665 C 39.65250601 40.97721387 43.66035569 5.01735270 8.28057341 -10.43850657 C 34.94340753 43.08802507 42.80887747 7.55555594 2.93939476 3.00718461 C 36.59061432 43.70591349 43.43982060 -7.62683286 -2.84913450 -2.89292159 C 39.50493887 39.74812168 40.36805486 -4.22147334 -5.61898307 4.77080013 C 40.89974943 41.22892384 41.12165250 -1.65074050 3.59546166 3.33132950 C 42.34497277 42.80178516 39.71375535 -4.66133632 1.86497870 -3.26705740 C 43.54829776 43.63207843 41.33114341 0.53897233 0.37871853 0.64110499 C 42.34450830 40.22034254 42.90879489 0.35145938 -0.23167260 -0.36129517 C 43.53101814 41.80408480 43.88425519 0.49632923 0.57708864 0.42366748 C 40.39757659 42.11536967 42.13716159 1.40655238 0.45913648 17.64347924 C 40.98769168 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