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=-36.11069175823841 stress="-0.0028393597466348512 0.00020579288016611978 3.5793503400549694e-05 0.00020579288016611978 -0.002605413050558959 0.0001552120456723481 3.5793503400549694e-05 0.0001552120456723481 -0.002632447677213985" free_energy=-36.11069175823841 pbc="F F F" Ni 20.70178472 21.29874826 20.77290972 -3.07338251 -2.66907108 -4.01671233 Ni 22.38090187 22.49752741 21.05835534 2.60965303 0.94428216 -9.01436292 Ni 22.24645637 20.98193431 22.42001865 5.45445391 -14.41140037 -6.02039784 Ni 21.20070203 22.20342959 22.40085166 -12.79149133 8.71333005 4.08648266 Ni 23.76222807 21.28187239 21.01001192 2.95735832 -7.35598600 -6.16123184 Ni 25.48453339 22.60170120 20.87793365 7.47832076 -4.24696322 -5.45305691 Ni 25.21904386 21.00082602 22.74624097 8.54260631 -10.88700055 -4.25212077 Ni 24.14302402 22.35498893 22.61042859 -4.81276337 3.20114851 -5.93300378 Ni 21.20947124 23.98481068 21.05280714 -12.04502512 -1.01491740 -9.70321538 Ni 22.63314411 25.34655491 20.87241235 0.21576853 7.24416180 -9.79576551 Ni 22.32230844 24.21026814 22.22286420 9.22426449 -4.90532352 11.71650022 Ni 20.93858073 25.25205420 22.65488783 -6.18633429 12.31900039 -3.11150243 Ni 24.05988540 23.70245745 21.16431082 -4.15339089 4.72693961 -7.43403360 Ni 25.31425730 25.67387870 21.03277713 3.03209857 0.48609578 -2.64842036 Ni 25.39971974 23.87366136 22.41558616 10.62787823 8.17993506 -0.98347734 Ni 23.85547244 25.71813893 22.26716069 1.05589188 4.05839609 6.53710573 Ni 21.19410236 20.83096497 23.88201197 -7.61510845 -6.90583575 4.94229097 Ni 22.63290316 22.22002482 23.77696427 -6.58856078 12.81018820 3.73073918 Ni 22.41661558 20.96512192 25.72586561 4.07806150 -8.49540684 4.28073983 Ni 21.29391194 22.22614529 25.52103145 -6.76671481 7.22390303 1.70015665 Ni 23.77761356 21.18220204 23.89362841 2.55412179 -13.80415787 6.69933957 Ni 25.73573857 22.52724172 23.77538150 9.78216470 -0.92862293 7.11636686 Ni 25.33257532 21.00607707 25.48648138 1.17917670 -1.09620613 0.72102980 Ni 23.78984966 22.48735431 25.42299150 2.89405737 3.20366743 6.78432671 Ni 20.90698366 24.18107110 23.82825321 -3.30125846 -8.47052376 7.24364277 Ni 22.63102478 25.59995250 24.26120756 -4.26537557 8.59415072 -11.50416876 Ni 22.51193751 24.25226748 25.46431997 -5.51499168 -11.49187926 6.39444679 Ni 21.04396501 25.57236142 25.58886938 -3.96240771 2.48574876 2.16033985 Ni 24.23854596 23.76922180 23.78229695 -7.56959134 5.70442021 2.41767490 Ni 25.52031036 25.68745344 24.02015752 1.89402639 3.63216279 -3.56938957 Ni 25.37970777 24.27711528 25.37871118 6.10240850 -4.08059797 5.87211166 Ni 23.75213077 25.23125112 25.21824351 8.96408530 7.23636207 7.19756519