64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=391332.9353227687 stress="-5.954486608171145 -0.14059624144519614 2.007846887090568 -0.14059624144519614 -3.547756041550909 -1.480243550071354 2.007846887090568 -1.480243550071354 -4.258773430246145" pbc="F F F" Md 34.88290411 34.75039391 35.10287617 -208.87943381 -168.82295129 -253.11037410 Md 36.15131305 35.76712509 36.68446918 -1748.87126985 -3063.69544037 2533.41023374 Md 36.91788143 36.83513358 35.32264884 1650.76537170 2228.04338025 -2991.48049411 Md 39.15543252 38.22241089 35.72186428 -2084.81722121 -8711.22495005 -74.63567613 Md 38.06255832 34.97996245 37.37954044 436.10082695 -350.61988266 -243.12616845 Md 38.55550970 35.56697254 39.46724046 -23482.99528147 9489.33258899 -28019.65490499 Md 35.79773350 37.68275739 37.37128610 -837.98674966 46.71040268 -329.11399558 Md 36.51314866 39.21376693 38.52159411 -608615.62344731 -219631.94571881 540945.93521460 Md 40.31104426 35.06322790 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