16
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=-52.12161666913536 stress="-0.00047100597341523344 1.3476405396483524e-05 -2.637328255181474e-05 1.3476405396483524e-05 -0.0002935808124966644 -7.81941622909409e-05 -2.637328255181474e-05 -7.81941622909409e-05 -0.00029082965362536075" pbc="F F F"
Ti      20.91870436      21.04860922      21.11044915      -0.63560043      -0.27718600      -0.66658057 
Ti      22.70960170      22.31143450      22.33833517      -2.24445908       3.90372823       0.87341519 
Ti      23.78829595      20.83509776      21.14041416       0.44290626      -3.13703397      -2.68621867 
Ti      25.27812781      22.51878885      22.10681310       3.09050759       0.65816083       1.81723371 
Ti      20.87679405      23.95894820      21.20259391      -1.44493012      -1.13804372      -0.67532415 
Ti      22.56504129      25.20865944      22.36550211      -1.79476494       4.86866596       2.81633386 
Ti      23.78802619      24.22277084      21.18584377       2.43475172      -1.07571074      -4.75954839 
Ti      25.67814238      25.53708740      22.48825709      -0.19624340      -0.30727976       1.06352317 
Ti      21.26959405      21.17626233      23.85402479      -3.04322667      -1.04307215       0.38856412 
Ti      22.52664478      22.41193524      25.65300231       0.35318777       0.16091013       2.56197480 
Ti      23.78244863      20.95774659      23.91852158       2.13038967      -2.41368474       0.83531026 
Ti      25.45789336      22.38825682      25.27041603       0.69331244       0.35677963       0.19648365 
Ti      21.19178619      24.17895518      24.29140871      -2.99012021      -1.22634940      -1.24552557 
Ti      22.70529265      25.53253581      25.64904689      -0.89475201       2.33044541       2.23375197 
Ti      23.78091226      24.10609294      24.23823960       2.16561664      -2.28494327      -3.27550404 
Ti      25.30598025      25.25538924      25.64494517       1.93342475       0.62461356       0.52211067