32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=1245.76251743 stress="-14.562910827882767 0.10437957906476947 -0.7371932703380051 0.10437957906476947 -13.738610108222803 -0.4720816725693503 -0.7371932703380051 -0.4720816725693503 -14.703432066839577" pbc="F F F" C -0.14459490 0.11115480 0.11044915 -29.60627821 -40.11491482 -45.99289847 C 1.70960170 1.34512630 -0.16166483 -9.31308528 10.59774124 -39.23612599 C 1.31428531 -0.16490224 1.36371066 -1.49881677 -41.69562972 3.18613212 C -0.22187219 1.48254321 1.23417995 -36.17366589 19.82897498 20.21943316 C 2.87679405 -0.04105180 0.20259391 13.71444719 -47.86570082 -28.98277191 C 4.56504129 0.96425659 -0.13449789 32.30503200 3.17171492 -36.45548072 C 4.28802619 0.22277084 1.68584377 26.89357010 -100.36078239 -78.29089266 C 3.18362810 1.69581920 1.64685009 -36.02482635 -43.59359772 -15.31847983 C 0.26959405 2.87804706 -0.14597521 -22.02067348 1.60889885 -42.16740745 C 1.70996341 4.49207130 0.15300231 -20.95205267 41.48358302 -58.86727645 C 1.53848316 2.95774659 1.71726984 -31.72786217 -18.45572038 -20.68167322 C -0.04210664 4.38825682 1.04332575 -38.94906695 32.70069424 6.54810312 C 3.19178619 3.17895518 0.29140871 -27.20656465 -22.36777063 -120.25289265 C 4.61455359 4.53253581 0.14904689 30.87870202 32.11349250 -23.74398177 C 4.28091226 2.98699481 1.46603997 123.86657890 14.51275021 23.82364859 C 2.80598025 4.32157598 1.51361598 22.95272387 88.14459447 27.35871349 C -0.14801295 -0.02432459 2.92466586 -46.93763615 -29.25278974 -1.25773894 C 1.49580977 1.02492495 2.97644859 -0.67630249 20.63968694 -13.82728850 C 1.26128685 -0.15859300 4.31668137 -4.98131358 -56.59054970 46.27662524 C -0.08013605 1.44466750 4.59073906 -29.70735775 0.22759406 26.66510076 C 3.27219963 -0.06618674 3.13132919 -16.67300491 -47.63235873 27.25050138 C 4.75978669 1.22592512 2.78504734 76.53539946 59.71639837 71.54381045 C 4.68365717 0.20288723 4.58343331 22.14246090 -14.68243397 31.14778647 C 2.49928362 1.34894620 4.72094491 15.98298167 4.23527090 40.98853183 C 0.23171545 3.17983874 3.10370736 -65.25744063 -15.37512333 -25.67754199 C 1.71219253 4.42485375 3.12990665 -16.30377858 71.97671816 -12.48836003 C 1.28220450 3.28278197 4.56210000 56.04938271 -81.57261951 64.20338566 C 0.13362859 4.32702941 4.57034430 -97.37330346 96.30274610 37.48831178 C 3.05853665 3.03926838 2.91561068 -1.77599407 -9.70816809 34.16063027 C 4.63661615 4.40480033 2.97889625 36.94451482 46.63804842 -4.12332876 C 4.29869006 3.11041876 4.26735611 49.44525685 -22.26659171 52.58971740 C 2.83533445 4.24148635 4.58611608 25.44797355 47.63584388 53.91370760