32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=4.716237186338494 stress="-0.005104396084835975 0.00031957542612955515 -9.476438572837336e-05 0.00031957542612955515 -0.004532764213633298 -1.5655138949541477e-05 -9.476438572837336e-05 -1.5655138949541477e-05 -0.004965188372228448" pbc="F F F" V 20.85540510 21.11115480 21.11044915 -6.25578603 -5.96595550 -9.49412144 V 22.74329349 22.31143450 20.83833517 -3.43567788 10.35671247 -8.15889874 V 22.31428531 20.83509776 22.36371066 1.59523538 -8.95109493 5.39605948 V 20.77812781 22.51878885 22.29209888 -6.56983708 5.54180677 2.40229797 V 23.78262948 20.95894820 21.20259391 5.11678077 -12.21507406 -6.76877949 V 25.56504129 21.96425659 20.86550211 5.90627607 3.58450939 -5.49294021 V 24.98981092 21.22277084 22.68584377 12.18140139 -22.39701882 -25.13955266 V 24.18362810 22.69581920 22.94559836 -13.12761776 -3.12785254 -8.49728073 V 21.26959405 24.17626233 20.85402479 -9.49618762 -10.02181720 -16.09302998 V 22.48287312 25.49207130 21.15300231 6.51232167 15.16333481 -12.17624711 V 22.53848316 23.95774659 22.29942344 -2.48374670 -12.32890115 3.56980112 V 20.95789336 25.38825682 22.13178262 -13.32178341 12.57427590 7.44936100 V 24.19178619 24.17895518 21.29140871 -10.92847727 -12.63309891 -37.19428738 V 25.61455359 25.53253581 21.14904689 6.59891404 7.63171050 -5.28462910 V 25.28091226 24.10609294 22.46603997 33.30806880 -5.29078189 12.17451859 V 23.86433559 25.32157598 22.51361598 -0.93523096 26.44006618 8.53824861 V 20.85198705 20.97567541 23.80975564 -9.79064744 -6.61821739 0.35947774 V 22.43745442 22.27846858 23.97644859 2.00055926 7.49804240 -1.17153746 V 22.34126820 20.84140700 25.31668137 2.08876423 -10.46101160 6.59404874 V 20.91986395 22.24396547 25.59073906 -6.15596713 4.77302658 5.51809857 V 24.27219963 20.93381326 24.13132919 -12.71929986 -16.22884094 14.43275693 V 25.75978669 22.22592512 23.78504734 22.78816786 12.55427306 10.95411157 V 25.68365717 21.12290588 25.58343331 7.81186647 -4.07810768 6.24603964 V 23.99655606 22.15152413 25.72094491 -3.07832633 6.96049886 8.68067367 V 21.23171545 24.18190327 23.72268664 -11.32863879 -4.58070917 2.49047242 V 22.71012800 25.42485375 24.12990665 -3.20904500 16.72452359 -7.27980794 V 22.28220450 24.28278197 25.56210000 18.79101946 -32.15556845 10.22060138 V 21.13362859 25.32702941 25.57034430 -29.23343904 24.44087272 4.84499586 V 24.04852473 24.05473499 23.91561068 -6.17164617 0.94558399 12.49238530 V 25.63661615 25.40480033 24.15906743 9.39604478 15.11809759 -6.44761595 V 25.29869006 24.11041876 25.26735611 9.30428364 -13.67033884 14.26168880 V 23.83533445 25.24148635 25.58611608 4.84165064 10.41705426 12.57309079