32 Lattice="43.421207427978516 0.0 0.0 0.0 43.421207427978516 0.0 0.0 0.0 43.421207427978516" Properties=species:S:1:pos:R:3:forces:R:3 energy=-41.83770236937623 stress="0.0006111416116982486 -7.949672539330715e-05 -5.499103088372009e-05 -7.949672539330715e-05 0.000614774540826874 2.1636819448741418e-05 -5.499103088372009e-05 2.1636819448741418e-05 0.0006224798484499412" free_energy=-41.83770236937623 pbc="F F F" N 21.91580452 21.82979040 21.58976116 2.13909405 2.31857356 3.46023616 N 23.11801733 23.43592049 21.58987747 -1.89178405 0.84230624 -0.47828645 N 23.30536707 21.63838607 23.13349021 2.27446059 1.11913509 -3.71811533 N 21.60428067 23.11328482 23.18677079 -0.86199635 2.05561786 -0.55959644 N 24.58117203 21.65942099 21.50398222 -1.99142704 -0.11973901 4.08138625 N 26.49194913 23.31126562 21.68127941 -3.79499640 -0.66387528 3.72262765 N 26.49980163 21.55581813 23.25172833 -1.62661717 2.76374902 0.06625809 N 24.83943281 23.17779424 23.15607892 3.95274768 -4.06308252 -1.63075881 N 21.67808433 24.63061276 21.89238615 0.99195914 -1.25677112 1.15304693 N 22.94097917 26.52462790 21.56974119 -1.49073742 -2.04580812 3.43947898 N 23.16303776 24.93133476 23.02804847 -1.88254564 2.01620518 -1.36024558 N 21.52474060 26.29338892 23.23229606 3.53286865 -1.75676351 -0.46550182 N 25.00033988 25.05704515 21.65915589 2.53888440 0.97064855 0.00906253 N 26.38040215 26.17755390 21.82051117 0.59150932 -1.12642638 -1.23233041 N 26.27423294 25.25518961 23.28406255 -0.23235086 -0.03876631 -0.77961556 N 24.62493645 26.11534537 23.13542196 -2.63393319 -0.39369345 1.71287024 N 21.89463115 21.53547843 24.80158045 3.41293369 1.79580229 0.84530500 N 23.19718737 23.18384751 24.96301111 -2.37248955 -2.79714655 1.42429025 N 23.11823880 21.81979103 26.44616968 -1.18672676 2.89783278 -2.27595659 N 21.92827668 23.27130905 26.57309884 2.23495921 -1.51622084 -1.48438876 N 24.78238517 21.74724122 24.87241972 0.66389759 2.63402529 0.49644326 N 26.53270375 23.46014942 24.61980336 -1.94732907 1.73214584 1.63397993 N 26.18145673 21.72752901 26.51908714 -3.79387449 2.20224004 -1.73161438 N 24.82891647 23.16111760 26.58582912 1.72806964 -4.20025947 -0.14672213 N 21.60952970 24.60556084 24.58816113 0.46736162 -1.74911008 -1.95822814 N 23.02656405 26.47634329 24.49642235 -0.15312820 -0.19710077 -1.95510312 N 23.36942960 24.99528959 26.61268973 -1.85511497 4.77419976 -0.82126006 N 21.86513542 26.32505046 26.42394208 3.49123645 -2.81912282 0.53286744 N 24.97869956 24.92012853 24.68787079 2.02629867 0.22153222 0.40257441 N 26.49387933 26.16758299 24.71634853 -0.79911000 -0.48516599 2.61942782 N 26.45789929 24.79773262 26.24675649 -0.93105901 0.04961236 -4.20644749 N 24.95453196 26.33796864 26.11471192 -0.60106050 -3.16457384 -0.79568388