0.000000 -0.014064 -0.005304 0.000000 0.014064 0.005304 -0.000000 0.008286 0.002109 0.000000 -0.008286 -0.002109 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 0.000000000 vasp 5.4.4 18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex tekla2IFC 2023-02-21T11:19:06.000 2.930659672237808 4.018602465 4.867908640765184 90.0 105.43 90.0 213.12079999999997 0 2 700 0.1E-06 -.1E-01 2 0.1000 0.0 44.0000 -1.0000 0 0.05 F 0 PE 8 0 false F 0.0000 PAW_PBE Ti_sv 26Sep2005|PAW_PBE Ni 02Aug2007 Ti Ni 47.88 58.69 12.00 10.00 2 2 2.9304109126145255 4.0196996174142265 4.87178520313002 90.0 105.44 90.0 213.12079999999997