32 Lattice="6.795567247090903 0.0 0.0 0.0 6.795567247090903 0.0 0.0 0.0 6.795567247090903" Properties=species:S:1:pos:R:3:forces:R:3 energy=-97.94431434939206 stress="-16.154461761343295 -16.279479523709067 -0.16849613504569758 -16.279479523709067 -60.10321139376482 -43.724743825019125 -0.16849613504569758 -43.724743825019125 -43.511609193940416" pbc="F F F" Ni 0.02937913 0.04950790 0.00756634 0.14286297 0.20235106 0.22971732 Ni 1.72940732 1.68792461 0.02058114 -0.15425507 0.45662712 -1.14264227 Ni 1.73430858 0.01136422 1.66947439 -2.42734133 385.77485543 394.36967084 Ni 0.03691436 1.69127010 1.74344697 -1.20164810 0.15529768 -0.04941820 Ni 3.40494738 0.04772931 0.05133677 0.00306551 -0.48841704 -0.59848943 Ni 5.09072259 1.70265689 0.02300036 0.15252865 0.38578721 -0.27134575 Ni 5.09393192 0.02498153 1.66556252 0.19792884 -0.11105513 0.52980627 Ni 3.42089041 1.69912131 1.68066343 -10.28283656 -4403.63461047 -4391.27171616 Ni 0.01701567 3.38959790 0.05477427 -0.28924591 -0.22846125 -0.26658391 Ni 1.68558439 5.07309397 0.02164775 0.15113496 0.28367532 -0.13080997 Ni 1.65922664 3.41158859 1.67841337 0.15429274 -0.19044368 0.34157777 Ni 0.00755841 5.11147825 1.72343220 0.03103652 0.09171868 0.29553341 Ni 3.37447767 3.41418357 0.01893560 0.24503282 -0.19842095 -0.96853391 Ni 5.10866941 5.09927294 0.02067285 -0.36932001 -0.44309708 0.39809196 Ni 5.10640741 3.37661178 1.71953294 0.82340963 0.03229461 -0.02555646 Ni 3.40761662 5.06077461 1.70210176 -0.22123841 1.06895972 0.04335424 Ni 0.02940990 0.00541886 3.40993482 0.00844555 -0.13845194 -0.16636563 Ni 1.69842476 1.69092019 3.38376441 0.22950909 0.58809047 0.10668806 Ni 1.68522076 0.05189239 5.12116423 0.36340922 -0.07496869 -0.02333496 Ni 0.00923952 1.70107029 5.09104117 -1479.95661789 -1481.71664606 -2.70469062 Ni 3.36738187 0.04680952 3.35690924 0.32461059 -1.05938895 0.43537511 Ni 5.10631320 1.71258457 3.41232207 0.66247482 -0.12112380 -0.20649108 Ni 5.08254326 0.01220205 5.10936392 -0.50008216 0.43420386 -0.47888382 Ni 3.39465455 1.73163868 5.09720159 -0.12190232 -0.29107844 0.77181883 Ni 0.01211257 3.42960659 3.42889190 -0.69878012 -0.33921100 -0.32136600 Ni 1.74672102 5.10992598 3.44835118 -0.15334809 0.83582312 -0.68182333 Ni 1.71593944 3.39828478 5.11786221 2.13035021 -387.18031589 -393.14082329 Ni 0.05168796 5.09117902 5.06458381 0.06600079 -0.05926111 -0.00771221 Ni 3.37647807 3.41938338 3.40688649 0.02823619 -0.54975284 -0.36698385 Ni 5.08893083 5.09495621 3.37144442 0.09383068 -0.07835662 -0.01356512 Ni 5.07359741 3.36380427 5.09219501 0.64937427 0.14746084 0.49525709 Ni 3.42867932 5.12526931 5.09711387 1489.91908192 5886.44591581 4394.82024508