32 Lattice="73.16403770446777 0.0 0.0 0.0 73.16403770446777 0.0 0.0 0.0 73.16403770446777" Properties=species:S:1:pos:R:3:forces:R:3 energy=-318.20967035859604 stress="-0.0013537535022119826 5.8158852766664474e-05 0.00015947759047811933 5.8158852766664474e-05 -0.0010573211650173014 9.002313901919786e-05 0.00015947759047811933 9.002313901919786e-05 -0.0014037707189000397" pbc="F F F" Np 36.42003099 36.52648309 36.44303323 1.68759855 0.51211187 1.22708492 Np 39.20433397 39.06066353 36.59012118 -14.84671227 8.39926667 -11.54945193 Np 39.31033655 36.57044631 39.02314303 -6.42620606 -6.68069537 19.36858572 Np 36.56726682 39.19511112 39.06072543 -12.75079332 -18.59911627 11.54266377 Np 41.73402915 36.80289482 36.58175460 10.44282677 -17.10654809 -21.31314900 Np 44.32259423 39.31897833 36.49846950 7.31108166 9.80492551 -7.47640721 Np 44.24279031 36.70199084 38.96188554 11.98246618 -11.76965095 9.36207665 Np 41.91656905 39.39166598 39.06794721 -12.94920652 -8.50266657 16.04646940 Np 36.76887530 41.67152194 36.68139962 -16.92072407 -2.40662239 -19.69675970 Np 39.01095716 44.28143805 36.55036497 27.63766169 19.14879900 -28.80255249 Np 39.05644906 41.59780310 39.34049742 35.38289987 18.80313702 -18.51163131 Np 36.81207308 44.40544080 38.95087662 -27.70486096 9.14105214 35.96763981 Np 41.35854143 41.79077183 36.70654195 23.25756704 7.47933578 -16.49159244 Np 44.50391750 44.31663013 36.64004196 3.73164162 1.27686842 -10.51111866 Np 44.59022958 42.02304815 39.34429857 5.72169242 -17.42124259 -12.18703459 Np 41.93420861 44.57582912 39.03097012 -11.01729346 -0.11280768 9.19714774 Np 36.80958156 36.55051908 41.80280694 -21.98379981 -9.93225755 -19.43140198 Np 39.08269907 39.17741043 41.74063037 30.97068945 -8.31003259 2.96006372 Np 39.11814308 36.46415053 44.25725139 11.49250756 -2.64587373 17.49910931 Np 36.58492092 39.30142059 44.14582108 -12.87481249 -6.48486160 15.31212297 Np 42.01292487 36.35758452 42.02460264 -20.18382134 -3.71437157 -21.00448374 Np 44.24938037 39.06377059 41.65757522 13.67018843 3.17128623 10.02976694 Np 44.35993735 36.35926755 44.47922024 13.36965115 0.97911679 11.95181615 Np 41.73929653 38.97147849 44.58990590 -3.09383576 8.00805453 -2.44866576 Np 36.75319906 41.81018806 41.67625213 -32.80106187 9.49881819 6.80685116 Np 39.40006473 44.49125881 41.86928760 -11.18075250 0.91348104 -17.24760412 Np 39.01674250 41.87841932 44.39466575 19.68514737 -6.48738505 6.12283310 Np 36.42177640 44.24124543 44.23637546 -6.11742904 9.92620784 3.52503326 Np 41.99636088 41.82411833 41.71668520 -23.80598865 -1.56855193 4.49935351 Np 44.46631503 44.36006044 41.86868592 3.77504866 14.63645451 8.64416426 Np 44.35009638 41.57808902 44.38484089 3.39174910 1.26801658 4.58531507 Np 41.71275502 44.45215966 44.38882829 11.14688060 -1.22424821 12.02375545