32 Lattice="21.0 0.0 0.0 0.0 21.0 0.0 0.0 0.0 21.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=110.1891863573234 stress="-0.02580238497962847 0.00011929440062015584 9.260084122017268e-05 0.00011929440062015584 -0.025500302476589094 -0.0006915432697795123 9.260084122017268e-05 -0.0006915432697795123 -0.023272800275721334" free_energy=110.1891863573234 pbc="F F F" H 10.40085166 10.49793547 10.78187239 -8.34118131 -8.03091814 -2.80108663 H 11.26001192 11.23453339 10.60170120 -8.17656679 -26.56924877 -40.70187303 H 11.28513772 10.21904386 11.01647448 -1.51595186 -13.97494923 -0.12244312 H 10.74624097 11.39302402 10.99006494 -39.16164348 -10.05548239 14.52121364 H 12.11042859 10.70947124 10.35512851 8.20765420 -12.96150474 -12.77562691 H 12.80280714 11.46102337 10.34655491 11.76876014 -2.05230891 -9.87026883 H 12.62241235 10.32230844 11.14322850 4.71942480 -5.85408313 1.26778462 H 11.72286420 11.18858073 11.00205420 24.77090890 -15.90038152 20.09029017 H 10.65488783 11.92054207 10.20245745 -16.62466337 4.94983568 -18.34525485 H 11.41431082 12.56425730 10.65933676 -12.30698554 40.78366490 0.81514971 H 11.25288837 11.89971974 10.82586454 -6.42991020 14.15454587 8.13125721 H 10.46097674 12.53219307 11.46813893 -36.87916797 30.61310330 -31.85935611 H 11.76716069 12.19410236 10.33096497 21.67127310 -2.57620834 -33.25488299 H 12.63201197 12.68300593 10.22002482 8.72276543 5.84525774 -5.26219314 H 12.52696427 11.63417444 11.07053623 16.12055832 3.25119089 3.04529470 H 12.22586561 13.04391194 10.87531678 7.84990349 12.32940632 1.52329260 H 10.52103145 10.27761356 12.18220204 -17.17425839 -7.85143371 -12.02752923 H 11.40598179 11.48573857 12.02724172 -4.04078797 -13.26078708 7.27127522 H 11.02538150 10.20296332 12.59887301 9.59875729 -16.75844663 10.16807019 H 10.72083292 10.88823062 12.73735431 -8.57277750 10.85330846 12.15202685 H 11.92299150 10.40698366 12.39112464 8.48894533 -6.46534372 1.50706053 H 12.57825321 11.59314210 12.04963940 12.41225419 -3.87959363 1.53033699 H 13.00163610 10.36880950 12.97891161 0.67392847 -0.88471039 0.56693998 H 11.96431997 11.53519401 12.82236142 3.89803493 -2.98208704 13.51796979 H 10.72580630 12.23854596 11.76922180 2.86706204 -29.32440369 13.20762135 H 11.03229695 12.77031036 12.18745344 10.14865922 25.65024632 13.56694660 H 11.08650100 11.87970777 13.02711528 -3.36189574 1.74002355 12.06876325 H 10.37871118 12.50213077 12.48125112 -17.74117317 3.90652999 18.64432899 H 11.71824351 12.13616082 11.76429260 12.98716787 12.27024179 1.76635378 H 12.87968218 12.96980528 12.22511896 2.91548781 3.77922223 0.77908954 H 12.93543805 11.94027218 12.82327937 7.78798176 1.64843367 5.70138381 H 12.01432830 12.87961200 12.62425859 4.71743602 7.60688035 5.17806532