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=54.370548197635266 stress="-0.0038527523501405924 -0.0009538702353667379 0.00022881731030535382 -0.0009538702353667379 -0.00411394397251327 0.0002830130387919987 0.00022881731030535382 0.0002830130387919987 -0.003210758666691638" pbc="F F F" Nb 34.79211049 35.13640012 35.47670360 2.06289997 1.38904453 1.81852044 Nb 36.73553718 36.09434927 36.85691143 -8.52880049 12.17657321 -9.97523911 Nb 37.65091303 37.22218198 34.94611138 -1.41570850 0.16940910 -0.70223838 Nb 39.28916674 38.44324783 35.91363056 0.97071734 2.34871381 -0.59544739 Nb 37.54854536 34.67423500 37.81170440 4.89195338 -16.51379990 6.13944431 Nb 38.67647898 36.63677095 38.64795095 -162.41277763 -21.04514308 64.90015402 Nb 35.04444664 37.90105583 37.52904778 -1.15910956 -0.55422556 -1.14489640 Nb 36.53268369 38.82820494 39.08640445 -4.50310112 0.91906650 0.96115175 Nb 39.98105449 35.64915519 34.62625521 -2.00098677 -0.46969100 -0.12086194 Nb 41.60760404 36.55965600 36.00439459 -31.05821743 -5.63482162 28.01079881 Nb 42.80820902 36.84827649 34.80539633 26.26780414 -5.33957237 -38.17006399 Nb 43.43783102 38.50688477 35.66956617 9.04315576 8.73810054 -1.31635812 Nb 42.71083570 35.30403873 37.60121717 -11.48012215 -11.35189465 -8.28685178 Nb 43.91996351 36.13440927 38.70950436 14.66414567 8.04485345 9.84468855 Nb 39.86354409 37.00203356 37.88688112 148.23528453 48.07581115 -100.25926772 Nb 41.25198966 38.53428504 39.39642865 -187.59456009 86.76184283 -66.04363331 Nb 35.31841281 39.94751650 34.92139371 -16.20446576 -41.81184949 -68.94466750 Nb 35.63009655 40.75121598 36.27048984 7.46100507 22.09859525 51.94821475 Nb 37.59499948 41.65705752 35.71971272 7.82883870 1.27007736 -3.59925777 Nb 37.78380530 43.72135411 36.27569564 0.02451356 2.14453721 1.68895220 Nb 37.40937731 39.84982902 37.37926216 7.12941341 -2.56207999 -0.99745411 Nb 38.81343399 41.37996245 39.19332522 -60.19404737 32.23038989 -2.45968005 Nb 35.47899752 42.18159420 37.47796174 -2.83198560 17.71887967 16.51738069 Nb 36.13762113 43.87231411 39.22619960 -8.42974505 5.68655425 -4.89234739 Nb 39.97925765 40.24284280 34.63237156 0.43041982 0.44847656 0.20066387 Nb 41.69400335 41.47710076 36.02910391 1.29174662 -4.57927379 0.11737762 Nb 42.42874006 42.74569740 34.56099674 2.18006941 3.23749984 -1.69187246 Nb 43.95187456 43.78704784 36.40834040 -2.37155373 -1.75914809 -0.40477737 Nb 42.81196991 39.57897526 37.23986440 -3.17025672 4.60700073 7.15761736 Nb 43.82852842 41.05949312 39.26476613 4.24762501 -2.46128602 -2.27083711 Nb 40.39090109 42.55800575 37.55517182 -35.50130203 -52.87418242 -71.82871148 Nb 40.93842517 43.49120044 38.68450067 29.54691588 66.32856681 62.83633985 Nb 35.39465222 35.63304878 39.26250119 -10.33353816 -4.62335569 -17.43884451 Nb 36.18745687 36.02230883 40.92014442 -5.28416340 -9.65512874 15.13030365 Nb 37.60286198 37.25778075 40.35346934 -4.09874094 -2.49241563 5.66763018 Nb 38.72269979 38.81754574 40.46769196 10.02224572 17.13984252 1.99986341 Nb 37.40284988 35.30281345 42.73745079 -14.97311609 -18.29899060 -3.23438802 Nb 38.81399505 36.42045171 43.28900512 -11.41452550 -64.48897752 57.11215299 Nb 35.57220360 37.31548843 42.67303835 -29.48015423 -16.74876768 -18.75758946 Nb 36.73277135 38.19732450 43.72681555 -35.31807384 -220.11894182 145.05174895 Nb 39.63213332 35.45906900 39.58604388 22.30687558 -31.54679821 27.23859223 Nb 42.02368593 36.51247831 40.76939388 -9.85661129 -34.15045929 23.95115178 Nb 42.47936796 37.95297311 39.81522638 196.41183251 -64.67210454 35.71655007 Nb 43.39124754 39.12799929 41.27166332 17.26017140 1.60792086 6.85158049 Nb 41.83903991 34.83771098 42.25483653 -0.39456508 0.30793051 1.31462342 Nb 44.11248824 36.92171977 44.15371098 -2.21580076 0.60134714 -1.98142150 Nb 39.32200649 37.66239499 42.47743121 36.55930177 74.82357358 -47.60653915 Nb 41.43094988 39.14235212 44.08679110 0.59700720 -1.30832608 1.78846203 Nb 34.64764578 40.29368674 40.22025637 -34.00048240 -31.52531908 -26.33355548 Nb 35.76725030 41.31538150 41.04482210 142.18749912 -87.13469058 -129.59401693 Nb 37.69533077 42.96134477 40.16611730 -45.43772917 -39.53345235 -31.52832917 Nb 38.74400789 43.85374949 40.99859303 48.64415151 45.38823775 38.01880022 Nb 37.02176770 39.40156751 43.11910378 57.92717228 242.46990582 -120.88445116 Nb 38.39445591 41.75154186 43.75126230 -15.96766366 -9.80642574 8.37326154 Nb 35.06317802 42.05658407 42.02745244 -109.86705950 118.65121189 156.62309364 Nb 36.55550457 43.64870191 44.05380973 1.56868053 -1.18149154 -1.42381502 Nb 40.17728387 40.49566835 39.16305883 54.44148045 -38.04749377 -8.94079259 Nb 41.37884593 41.38629877 40.92536678 -102.41642218 -69.90026830 89.87914586 Nb 42.13986266 42.24044499 40.02333546 99.47701742 107.22281268 -104.37562238 Nb 43.87163697 43.67943472 41.75929700 -1.27781833 -1.93202195 0.07371188 Nb 41.73335232 40.06725415 42.03542751 -1.11957260 -30.26443454 32.99021758 Nb 43.07304429 41.56437852 43.39918165 1.06223921 1.48885784 -0.06909651 Nb 39.81405098 42.77166086 42.94701151 -149.51902859 -136.78915921 -44.33843948 Nb 40.85683667 43.69242952 43.19734631 167.08962274 147.08035756 40.28917061