64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2354.5727319907296 stress="-0.010798277691440624 -0.00144191642583361 -0.001511692475523707 -0.00144191642583361 -0.010542100259398656 -0.0010896044877271186 -0.001511692475523707 -0.0010896044877271186 -0.01016950647443116" free_energy=2354.5727319907296 pbc="F F F" Br 34.75900849 35.18525799 35.18408192 -43.23555292 -21.27683634 -19.52507594 Br 36.59933616 35.93572417 35.98055861 -12.57013510 -88.04647802 51.15638530 Br 37.14715992 37.22516294 35.23402360 17.71096228 60.09145070 -87.13788655 Br 38.17972598 38.78131475 35.96390753 19.13043686 10.98489703 -38.85031107 Br 37.29465675 34.93158033 38.29951531 -72.65309630 -60.30092217 -4.74148992 Br 38.85840215 35.56228436 38.11272147 82.65249871 23.66229325 -33.69573190 Br 34.64671032 37.42336993 37.80973961 -26.54094843 3.20707914 -11.24920762 Br 36.55604684 39.07636534 38.99475015 -88.88275226 138.31046661 -82.27476100 Br 40.44932342 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39.62151619 66.22402230 -152.65060079 74.89278658 Br 38.55150311 38.51894432 41.34725891 -57.72622750 -79.66001451 73.85021056 Br 36.60669204 34.96989052 42.36669775 -2.09032583 -20.97502790 27.74577639 Br 39.08450338 35.75571598 43.58475277 -38.81436189 -40.99976125 38.70245011 Br 34.99655912 37.96978731 42.51668654 -61.42602760 -44.31652971 -25.03518687 Br 36.22422232 38.91950201 43.54655608 -30.15501269 -29.61841277 93.16414941 Br 39.29076361 35.00137669 40.24235409 6.88868091 -21.07844535 27.94094908 Br 41.48837336 36.00831489 41.43404765 -40.52148536 78.26840308 -87.52319770 Br 42.84911873 37.69580315 39.83531350 -94.60718118 21.30927987 -48.93746318 Br 43.60556472 38.49425818 41.03735392 67.84577247 62.23798896 85.03552342 Br 42.20384740 34.85081933 42.03810700 76.25000875 -136.04608977 54.93109850 Br 43.56377938 36.33000155 44.00814638 13.55057858 2.73861920 14.43320403 Br 40.36165000 37.00409575 42.75789894 -12.55952600 11.23143243 -12.30267312 Br 40.94042883 38.49218772 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13.48674050 -6.95886010 2.77539193 Br 43.82327501 41.51964143 44.08965562 19.78817282 10.90697738 22.30118306 Br 40.39757659 42.11536967 42.13716159 -57.86548448 78.67024325 98.37237672 Br 41.21229100 43.58445095 43.42700884 11.71143781 39.69221900 35.88440810