32
Lattice="67.77281951904297 0.0 0.0 0.0 67.77281951904297 0.0 0.0 0.0 67.77281951904297" Properties=species:S:1:pos:R:3:forces:R:3 energy=-12.239425236312321 stress="-0.00011715600282333079 -5.8737133019974245e-06 -6.7398828433503705e-09 -5.8737133019974245e-06 -0.00012051391691084834 1.7166785228637322e-05 -6.7398828433503705e-09 1.7166785228637322e-05 -0.00010866757159203126" pbc="F F F"
Ca      33.91470926      33.89465797      33.98197590      -0.08693384       0.00696886      -0.12894233 
Ca      36.47959775      36.36305794      33.91809237      -1.93247220      -0.64842607      -0.59436683 
Ca      36.50742023      34.04810059      36.08604824      -3.04297570      -1.29900034       2.87020658 
Ca      34.10235678      36.33037845      36.37863054      -1.12135282       0.96266287      -1.55982768 
Ca      38.63497886      33.93322071      34.11420586       3.02377218      -0.46016380      -2.42897430 
Ca      41.05198760      36.38460755      33.80461888       0.03254786      -0.03357360       0.19986092 
Ca      41.32743742      34.06330480      36.53543175      -0.19142429      -0.41549927      -0.41255071 
Ca      38.54988191      36.41363824      36.55145062       1.08691278       0.15786507      -0.68063817 
Ca      33.89426098      38.93060636      33.95788138      -0.21403950      -0.75608771      -0.19696448 
Ca      36.39592572      40.97397322      33.87406561      -0.25510344       0.83659377      -0.20009608 
Ca      36.45554986      38.78961323      36.46632410      -2.37073087      -1.05225988      -1.64781936 
Ca      33.67945649      40.95740121      36.49989686       0.17177061       2.09687155      -1.66880870 
Ca      38.49894124      38.56727561      33.76356707       1.90244230       1.25810833      -0.02732753 
Ca      41.06095973      40.92332685      33.77371742      -0.15112951       0.45818923      -0.54796692 
Ca      41.26915737      38.94375364      36.23662190      -0.17844842      -0.51941623       0.58042724 
Ca      38.56277964      41.12984995      36.34938149       1.80487788       1.32695926      -1.59432839 
Ca      33.81514884      34.10747275      38.61936596      -1.64491598      -1.96875855       0.38691563 
Ca      36.07916464      36.06804745      38.70372975       1.91372002       2.92288231       0.75661918 
Ca      36.25596382      34.02578975      41.11174146      -0.50657125      -0.65642645       1.15846022 
Ca      33.90820146      36.52985985      41.19523203      -1.11811861      -0.89030524       0.12201133 
Ca      38.45181301      34.01380425      38.81638411       1.05963707      -1.21717985      -1.01164248 
Ca      41.06023942      36.51636309      38.55362018       0.35809438       0.29568747       0.73173197 
Ca      40.96700978      33.82605367      40.91731039       0.46655121      -0.19776792       0.09843444 
Ca      38.76453451      36.26071164      41.06261805      -0.28540490       1.07038386       0.39666210 
Ca      33.65735294      38.93406983      38.65894312       0.11768055      -2.07822164       1.81856440 
Ca      36.50591908      41.04235547      38.63124197      -3.71437838       2.85601669       1.05328316 
Ca      36.03768844      38.75089056      41.13228281       1.08452203       0.38787000      -0.10127073 
Ca      33.80745211      41.24460979      41.16878412      -0.00508042       0.15760888      -0.05589491 
Ca      38.60062775      38.97649082      38.61717680       3.12747607      -3.17912954       1.40022128 
Ca      41.19592760      41.39138093      38.83617585      -0.14127624       0.27503321      -0.44398848 
Ca      41.02570835      38.92027463      40.91977911       0.39398617      -0.58188023       0.49612587 
Ca      38.47955844      40.96194393      41.09020121       0.41636524       0.88439495       1.23188376