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=-7.697023321756065 stress="-0.0011773103614916842 0.00017417139161421722 0.00010344282376830413 0.00017417139161421722 -0.0011324569416732615 0.0001520128489833438 0.00010344282376830413 0.0001520128489833438 -0.0010975143874053118" pbc="F F F" H 20.99793547 21.28187239 21.01001192 -1.42352312 -1.99467311 -1.91097933 H 22.48453339 22.60170120 20.87793365 3.37662144 -2.33512497 -2.04199016 H 22.21904386 21.00082602 22.74624097 3.74981801 -6.62570611 -2.84994653 H 21.14302402 22.35498893 22.61042859 -4.81083565 2.96172237 -2.83576783 H 24.20947124 20.85512851 21.05280714 -7.38128653 -2.09470053 -6.05120579 H 25.41333883 22.34655491 20.87241235 3.58486947 0.70149837 -1.56167536 H 25.32230844 20.91049160 22.22286420 7.04275573 -1.74648301 6.68783238 H 23.93858073 22.25205420 22.65488783 3.96119684 5.39712236 -10.86656681 H 21.05988540 23.70245745 21.16431082 -5.49886706 1.51761419 -2.39377490 H 22.31425730 25.25408911 21.03277713 3.65103196 1.03452059 -3.53698536 H 22.39971974 23.87366136 22.46097674 5.34325247 3.01673674 -0.81693455 H 21.07987761 25.70087583 22.26716069 -2.55921692 1.13912777 2.94511909 H 24.19410236 23.69162164 21.05290808 -2.95639395 0.76569294 -1.46874226 H 25.43300593 25.22002482 21.03931765 3.91301747 1.60594503 -4.02760463 H 25.41661558 23.96512192 22.72586561 6.80818563 -3.46397646 -1.01045965 H 24.29391194 25.22614529 22.36941241 -6.72111268 5.00028747 2.66942636 H 20.77761356 21.18220204 23.89362841 -3.18033090 -2.77761550 4.25680958 H 22.73573857 22.52724172 23.77538150 -5.32233627 1.82376792 7.63806007 H 22.41301687 21.06099032 25.67051982 0.46194231 -0.76182063 -0.14694698 H 21.08579638 22.64445890 25.42299150 -0.98953895 -0.25552118 1.45415791 H 23.90698366 21.18107110 23.82825321 2.59135121 -9.33193330 7.43701264 H 25.63102478 22.59038103 24.26120756 3.01409387 0.31138801 -2.43503887 H 25.36880950 21.25226748 25.46431997 1.42716572 -4.17152897 1.97117065 H 24.04396501 22.54900555 25.70379337 -2.92922038 1.52265233 1.48520331 H 21.23854596 23.76922180 23.78229695 -4.49354363 3.31775022 2.39265790 H 22.76153936 25.68745344 24.02015752 -0.94207070 1.27570189 -2.46284262 H 22.37970777 24.27711528 25.37871118 2.39687367 -1.98323797 2.18462322 H 20.75213077 25.23125112 25.24025645 -2.12659371 1.54694763 0.07091774 H 24.13616082 23.76429260 23.94602566 -2.60845942 2.97782456 2.75042960 H 25.64514769 25.78543930 23.99986912 0.72705812 0.34373423 -0.22676122 H 25.45460942 24.11704107 25.69989723 2.61264108 -0.94316930 1.16287692 H 24.12961200 25.37425859 25.37771936 -0.71854514 2.22545642 1.53792548