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=-14.191001874230137 stress="5.469575853062106e-05 4.402266889289419e-06 -1.355347830512812e-05 4.402266889289419e-06 5.827206815155313e-05 1.0729943675006322e-05 -1.355347830512812e-05 1.0729943675006322e-05 6.211766860781854e-05" pbc="F F F" F 35.53766333 34.84508600 34.85990953 0.09441097 0.12412041 0.16221878 F 36.33319670 36.09792079 36.38794473 0.13530063 -0.26551366 -0.07018047 F 38.16399463 37.53432496 34.98041454 0.01243845 0.00344561 0.06670276 F 39.36062435 39.58782536 36.68453303 -0.81217417 0.31104684 -1.35290086 F 37.72718982 34.71961578 36.90538068 -0.12201484 0.24142377 -0.04648867 F 39.47294710 35.45836125 38.32160716 -0.01442279 0.09493016 -0.04940727 F 34.88880093 37.95712732 37.71364141 0.15376784 0.05967583 0.03742169 F 36.67082962 39.00490121 38.53604797 0.20406123 0.01533049 -0.34553495 F 39.61374860 34.99308544 34.59634184 0.10128353 0.11179579 0.11074695 F 41.15143509 36.10671608 35.67451065 0.14156259 0.47098634 -0.19883127 F 41.90394146 37.67592982 35.20412821 -0.19080417 -0.45278887 0.24199240 F 43.49788876 39.00936294 36.04169834 -0.17641518 0.00432652 0.02194031 F 42.56539544 35.09011043 37.82237660 0.54026542 0.50726359 0.37405855 F 43.74501193 36.06595075 38.62140051 -0.62481311 -0.39063752 -0.32413324 F 39.95194946 37.67184091 38.03509243 1.55005039 1.20973764 0.71963345 F 41.05584236 38.50988654 38.54773043 -1.65092007 -1.13641421 -0.67163638 F 35.11574139 40.09119595 35.44495606 0.04389955 0.04574778 0.04788623 F 36.17105128 41.99454359 36.99941202 -1.67033577 0.31048585 0.81512871 F 36.92185515 42.18415162 34.75496104 -0.03670839 -0.02793868 0.11352832 F 39.22136223 43.91067465 36.12052072 0.04139946 -0.07978037 0.06006260 F 37.89931368 39.34139806 37.13605356 1.32106745 0.18664991 -0.16169652 F 38.95603909 41.86495707 38.49055382 0.77593573 -0.11176568 -0.64421432 F 34.85748725 42.25703864 37.68368635 1.75284583 -0.33508678 -0.86028477 F 36.02834003 43.63753557 39.58526997 0.02277842 -0.17223544 0.02154395 F 39.81079778 39.96002477 35.31490863 -0.12359247 0.02121135 2.23173349 F 40.93749478 41.16508448 35.88297145 0.42744638 0.31584313 -0.50840476 F 42.04987045 41.92810078 35.09860626 -1.08348047 -0.74329549 0.91936296 F 43.50717494 43.29457156 36.24880774 -0.10293484 -0.09222617 -0.04232339 F 42.50806783 40.57792197 37.40509156 -0.08042486 -0.00167060 -0.11250532 F 43.72635649 41.18804255 39.41485344 -0.13507251 0.11507802 0.03550218 F 40.08199947 41.82669597 37.41425709 -0.78376383 0.05879896 0.76025442 F 41.01729027 43.44897637 38.06217066 -0.19237591 -0.33393117 -0.12780944 F 34.95779057 35.20348199 40.38582281 0.53896026 0.44895833 0.32585420 F 36.20520999 36.21640220 41.11790954 -0.79168902 0.68826547 0.54324704 F 37.76416731 37.67310283 40.57606736 0.56439895 0.84554638 0.52936043 F 38.67576750 38.86756691 41.18842722 -0.64264587 0.12359308 0.64954927 F 37.66220771 34.96978325 42.05411399 -0.12639539 0.15367016 -0.10262461 F 39.47017742 36.26228497 44.22620927 0.02364339 0.02157128 -0.06465716 F 35.62965457 37.41072916 41.98167187 0.60221348 -1.05486119 -0.79140761 F 36.17058766 38.69906357 43.93042917 0.00298581 -0.04016968 -0.09824914 F 40.36813034 34.79101627 40.75840562 0.12716628 0.29492271 0.16364637 F 41.01938128 36.45829613 41.69803611 -0.33337493 1.23155663 0.91085782 F 42.85186951 37.71209661 40.05059741 1.09621622 1.10881534 1.16778626 F 43.50843325 38.37876736 40.75377143 -1.21342937 -1.11405453 -1.14022904 F 42.12447642 35.36923570 42.33117056 -0.61051467 0.76799050 -0.36112358 F 43.76141424 36.37245810 43.31466768 -0.16282314 -0.07146502 -0.10893210 F 40.45700570 37.73240825 42.10105792 0.82898070 -1.95138564 -0.61913451 F 40.36734104 39.36083595 43.63994323 -0.09000884 -0.06980062 -0.20319959 F 34.67741040 39.67328064 40.57001368 0.09166443 0.08201343 0.01525365 F 35.69633001 41.69496129 40.93203331 -0.14628363 0.16061773 0.16920127 F 37.68724479 41.80676706 39.77091224 0.35028787 0.06201773 -0.38031990 F 39.01417749 43.58199477 41.08924598 0.33391286 -0.49319114 1.72373148 F 38.46339336 39.75132277 42.44854909 0.33959004 -0.93236298 -1.24604135 F 38.57532321 41.52298024 44.17036645 0.05794947 0.01674880 -0.11780800 F 34.72722569 42.55288057 42.34850623 0.23462356 -0.17973702 -0.31024047 F 36.37170322 43.96618592 44.23082791 -0.00024052 -0.02350226 -0.02294700 F 39.69683714 39.82967576 39.80613782 0.07064808 0.08107856 0.28069484 F 40.80149723 41.22501322 40.53582870 -0.22612245 -0.25382022 -0.17690786 F 42.74643901 42.92752323 40.39772692 -6.15338929 -3.79669209 -3.78329703 F 43.57681517 43.41677700 40.89785101 6.15842846 3.58170908 3.70038560 F 42.84923479 39.60928833 42.57415353 0.05603726 0.48183180 0.04522298 F 43.07330786 41.35591867 43.04262539 -0.08734369 -0.55506053 -0.18987423 F 39.30229384 43.23141594 42.54186870 0.32176676 0.49780738 -0.88389284 F 40.35713882 43.44214532 43.80425234 -0.73347354 -0.17722481 -0.84727133