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=2.5154774777826368 stress="-0.005936601551095255 -0.00025796602865964393 0.0002563265063338247 -0.00025796602865964393 -0.006406572489291359 0.0001361963207050363 0.0002563265063338247 0.0001361963207050363 -0.006097241821365094" free_energy=2.5154774777826368 pbc="F F F" Ni 20.72051529 21.19273990 20.80722932 -11.43464595 -14.21679157 -5.90142222 Ni 22.26172667 22.38075321 20.88436473 6.56434685 -1.91415375 -27.58720947 Ni 22.52656970 20.99816022 22.51283276 4.01409241 -18.99342785 7.94170252 Ni 21.20071341 22.32858036 22.64720807 -15.43392654 8.47752279 6.49874360 Ni 24.08942344 20.95706424 21.27559981 -7.78593513 -13.80247366 -13.11324592 Ni 25.21321713 22.42677066 20.78604778 16.38135707 4.47011634 -16.85988585 Ni 25.70384132 20.79224623 22.23214964 17.90518893 -11.52252865 8.36078758 Ni 24.11934967 22.75551247 22.35444624 -2.82371555 5.17343125 13.72095251 Ni 20.99188881 23.79439635 20.84620060 -17.91693556 0.87816774 -9.17626022 Ni 22.35706902 25.20575425 20.96963223 3.80762525 16.35252303 -10.63306914 Ni 22.65586213 23.90395547 22.33226600 -0.19223807 -2.32043648 6.54085140 Ni 20.73049600 25.62036030 22.45631248 -4.45483844 6.14575086 3.99933849 Ni 24.24843919 24.18359480 20.76023492 2.63182874 3.19297314 -18.26785675 Ni 25.74849743 25.75911890 21.19019325 5.29260563 6.26604798 -9.65974659 Ni 25.69877714 24.10881314 22.63250256 19.12996824 -6.55534731 -5.75551228 Ni 24.10031152 25.55442580 22.58441914 -4.96023897 19.37009635 -4.03214186 Ni 20.78011711 21.13572127 24.15358219 -11.64022202 -19.83932083 2.01676034 Ni 22.23387496 22.71030909 24.06603388 10.27223390 -1.20154978 -8.25364469 Ni 22.50693356 21.16501753 25.72580078 -7.24806629 -16.10282239 12.24616973 Ni 20.92866320 22.80916330 25.49955875 -13.35060256 -1.42818976 20.96985331 Ni 24.22142913 20.94832183 24.25980354 -6.69245722 -12.28105886 -14.84235216 Ni 25.46667242 22.77143892 23.90295338 4.27988504 -4.41111852 -8.62154879 Ni 25.60338854 21.24759167 25.61018303 20.14751361 -13.73728449 13.30758716 Ni 23.92518197 22.24663523 25.48702489 -8.00785532 11.64910049 10.84281616 Ni 20.94857885 24.18843096 24.17061300 -17.65177709 3.33675606 -15.64614809 Ni 22.79169807 25.46863002 23.94630638 -4.67568996 18.17575744 -9.02406343 Ni 22.53851086 24.14982991 25.24795387 9.71272928 -8.34616626 18.66406136 Ni 20.82929456 25.28747849 25.39476746 -11.19238265 18.38064989 11.81121371 Ni 23.87993804 24.28095696 24.03647478 -4.40353241 -9.42429413 0.50811788 Ni 25.76008946 25.37675974 23.82230465 13.01200221 19.39290640 4.95451399 Ni 25.78460712 23.75346517 25.26772449 6.65384168 3.77627072 16.42638378 Ni 23.77715687 25.24014891 25.43198894 10.05984089 11.05889379 18.56425396