#VESTA_FORMAT_VERSION 3.3.0 CRYSTAL TITLE Ca Li2 GROUP 194 1 P 63/m m c SYMOP 0.000000 0.000000 0.000000 1 0 0 0 1 0 0 0 1 1 0.000000 0.000000 0.000000 -1 0 0 0 -1 0 0 0 -1 1 0.000000 0.000000 0.000000 0 -1 0 1 -1 0 0 0 1 1 0.000000 0.000000 0.000000 0 1 0 -1 1 0 0 0 -1 1 0.000000 0.000000 0.000000 -1 1 0 -1 0 0 0 0 1 1 0.000000 0.000000 0.000000 1 -1 0 1 0 0 0 0 -1 1 0.000000 0.000000 0.500000 -1 0 0 0 -1 0 0 0 1 1 0.000000 0.000000 0.500000 1 0 0 0 1 0 0 0 -1 1 0.000000 0.000000 0.500000 0 1 0 -1 1 0 0 0 1 1 0.000000 0.000000 0.500000 0 -1 0 1 -1 0 0 0 -1 1 0.000000 0.000000 0.500000 1 -1 0 1 0 0 0 0 1 1 0.000000 0.000000 0.500000 -1 1 0 -1 0 0 0 0 -1 1 0.000000 0.000000 0.000000 0 1 0 1 0 0 0 0 -1 1 0.000000 0.000000 0.000000 0 -1 0 -1 0 0 0 0 1 1 0.000000 0.000000 0.000000 1 -1 0 0 -1 0 0 0 -1 1 0.000000 0.000000 0.000000 -1 1 0 0 1 0 0 0 1 1 0.000000 0.000000 0.000000 -1 0 0 -1 1 0 0 0 -1 1 0.000000 0.000000 0.000000 1 0 0 1 -1 0 0 0 1 1 0.000000 0.000000 0.500000 0 -1 0 -1 0 0 0 0 -1 1 0.000000 0.000000 0.500000 0 1 0 1 0 0 0 0 1 1 0.000000 0.000000 0.500000 -1 1 0 0 1 0 0 0 -1 1 0.000000 0.000000 0.500000 1 -1 0 0 -1 0 0 0 1 1 0.000000 0.000000 0.500000 1 0 0 1 -1 0 0 0 -1 1 0.000000 0.000000 0.500000 -1 0 0 -1 1 0 0 0 1 1 -1.0 -1.0 -1.0 1 0 0 0 0 0 0 0 0 TRANM 0 0.000000 0.000000 0.000000 1 0 0 0 1 0 0 0 1 LTRANSL -1 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 LORIENT -1 0 0 0 0 1.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 1.000000 LMATRIX 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 CELLP 6.268000 6.268000 10.219000 90.000000 90.000000 120.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 STRUC 1 Li Li2 1.0000 0.167000 0.334000 0.250000 6h mm2 0.000000 0.000000 0.000000 0.00 2 Ca Ca1 1.0000 0.333333 0.666667 0.062700 4f 3m. 0.000000 0.000000 0.000000 0.00 3 Li Li1 1.0000 0.000000 0.000000 0.000000 2a -3m. 0.000000 0.000000 0.000000 0.00 0 0 0 0 0 0 0 THERI 1 1 Li2 1.000000 2 Ca1 1.000000 3 Li1 1.000000 0 0 0 SHAPE 0 0 0 0 0.000000 0 192 192 192 192 BOUND 0 1 0 1 0 1 0 0 0 0 0 SBOND 1 Ca Li 0.00000 3.00000 0 1 1 0 1 0.250 2.000 127 127 127 0 0 0 0 SITET 1 Li2 1.5700 128 0 255 134 224 116 204 0 2 Ca1 1.9700 90 150 189 90 150 189 204 0 3 Li1 1.5700 128 0 255 134 224 116 204 0 0 0 0 0 0 0 VECTR 0 0 0 0 0 VECTT 0 0 0 0 0 SPLAN 0 0 0 0 LBLAT -1 LBLSP -1 DLATM -1 DLBND -1 DLPLY -1 PLN2D 0 0 0 0 ATOMT 1 Li 1.5700 128 0 255 134 224 116 204 2 Ca 1.9700 90 150 189 90 150 189 204 0 0 0 0 0 0 SCENE 0.902515 -0.430658 -0.000672 0.000000 0.031666 0.064805 0.997395 0.000000 -0.429493 -0.900186 0.072124 0.000000 0.000000 0.000000 0.000000 1.000000 0.000 0.000 0.000 1.103 HBOND 0 2 STYLE DISPF 37753794 MODEL 2 1 0 SURFS 0 1 1 SECTS 96 1 FORMS 0 1 ATOMS 0 0 1 BONDS 1 POLYS 1 VECTS 1.000000 FORMP 1 1.0 0 0 0 ATOMP 24 24 0 50 2.0 0 BONDP 1 16 0.250 2.000 127 127 127 POLYP 204 1 1.000 180 180 180 ISURF 0 0 0 0 TEX3P 1 0.00000E+000 1.00000E+000 SECTP 1 0.00000E+000 1.00000E+000 0.00000E+000 HKLPP 192 1 1.000 255 0 255 UCOLP 0 1 2.000 0 0 0 COMPS 1 LABEL 1 12 1.000 0 PROJT 0 0.962 BKGRC 255 255 255 DPTHQ 1 -0.5000 3.5000 LIGHT0 1 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 20.000000 0.000000 0.000000 0.000000 -1.000000 26 26 26 255 179 179 179 255 255 255 255 255 LIGHT1 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 20.000000 0.000000 0.000000 0.000000 -1.000000 0 0 0 0 0 0 0 0 0 0 0 0 LIGHT2 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 20.000000 0.000000 0.000000 0.000000 -1.000000 0 0 0 0 0 0 0 0 0 0 0 0 LIGHT3 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 0.000000 0.000000 1.000000 0.000000 0.000000 20.000000 0.000000 0.000000 0.000000 -1.000000 0 0 0 0 0 0 0 0 0 0 0 0 ATOMM 204 204 204 255 25.600 BONDM 255 255 255 255 128.000 POLYM 255 255 255 255 128.000 SURFM 0 0 0 255 128.000 FORMM 255 255 255 255 128.000 HKLPM 255 255 255 255 128.000