#VESTA_FORMAT_VERSION 3.3.0 MAGNETIC_CRYSTAL TITLE 5yOhtAoR GROUP 15 90 C_c2/c PSPGR 71 1 I m m m SYMOP 0.000000 0.000000 0.000000 1 0 0 0 1 0 0 0 1 1 0.500000 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 0.500000 0.000000 0.000000 1 0 0 0 -1 0 0 0 1 1 0.500000 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 0.500000 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 0.250000 0.500000 0.750000 1 0 0 0 1 0 0 0 1 1 0.750000 0.500000 0.750000 -1 0 0 0 1 0 0 0 -1 1 0.250000 0.500000 0.750000 -1 0 0 0 -1 0 0 0 -1 1 0.750000 0.500000 0.750000 1 0 0 0 -1 0 0 0 1 1 0.750000 0.500000 0.750000 1 0 0 0 1 0 0 0 1 -1 0.250000 0.500000 0.750000 -1 0 0 0 1 0 0 0 -1 -1 0.750000 0.500000 0.750000 -1 0 0 0 -1 0 0 0 -1 -1 0.250000 0.500000 0.750000 1 0 0 0 -1 0 0 0 1 -1 0.500000 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 0.500000 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 1 0 0 0 1 0 0 0 1 -1 0.500000 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 0.500000 0.000000 0.500000 1 0 0 0 -1 0 0 0 1 -1 0.750000 0.500000 0.250000 1 0 0 0 1 0 0 0 1 1 0.250000 0.500000 0.250000 -1 0 0 0 1 0 0 0 -1 1 0.750000 0.500000 0.250000 -1 0 0 0 -1 0 0 0 -1 1 0.250000 0.500000 0.250000 1 0 0 0 -1 0 0 0 1 1 0.250000 0.500000 0.250000 1 0 0 0 1 0 0 0 1 -1 0.750000 0.500000 0.250000 -1 0 0 0 1 0 0 0 -1 -1 0.250000 0.500000 0.250000 -1 0 0 0 -1 0 0 0 -1 -1 0.750000 0.500000 0.250000 1 0 0 0 -1 0 0 0 1 -1 -1.0 -1.0 -1.0 0 0 0 0 0 0 0 0 0 TRANM 1 -0.000000 -0.000000 -0.000000 0 0 1 0 1 0 -2 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 7.655900 5.932100 23.323601 90.000000 90.000000 90.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 STRUC 1 Nd Nd1 1.0000 0.250000 0.000000 0.101350 16i m' 0.000000 0.000000 0.000000 0.00 2 Ba Ba1 1.0000 0.250000 0.500000 0.000000 8b 2/m' 0.000000 0.000000 0.000000 0.00 3 Ni Ni1 1.0000 0.000000 0.000000 0.000000 8c 2'/m' 0.000000 0.000000 0.000000 0.00 4 O O1 1.0000 0.000000 0.241900 0.072200 32j 1 0.000000 0.000000 0.000000 0.00 5 O O2 1.0000 0.000000 0.500000 0.250000 8a 2/m' 0.000000 0.000000 0.000000 0.00 0 0 0 0 0 0 0 THERI 0 1 Nd1 1.000000 2 Ba1 1.000000 3 Ni1 1.000000 4 O1 1.000000 5 O2 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 Ni O 0.00000 2.28149 0 1 1 0 1 0.250 2.000 127 127 127 0 0 0 0 SITET 1 Nd1 1.4000 251 141 6 251 141 6 40 0 2 Ba1 1.6000 30 239 44 30 239 44 40 0 3 Ni1 1.2500 183 187 189 183 187 189 40 0 4 O1 0.5000 254 3 0 254 3 0 40 0 5 O2 0.5000 254 3 0 254 3 0 40 0 0 0 0 0 0 0 VECTR 1 -0.05000 0.00000 2.65000 0 1 0 0 0 0 0 0 0 0 0 2 0.90000 0.00000 -1.30000 0 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 VECTT 1 0.500 255 0 0 3 2 0.500 255 0 0 3 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 Nd 1.4000 251 141 6 251 141 6 40 2 Ba 1.6000 30 239 44 30 239 44 40 3 Ni 1.2500 183 187 189 183 187 189 40 4 O 0.5000 254 3 0 254 3 0 40 0 0 0 0 0 0 SCENE -0.415460 0.909544 -0.011034 0.000000 -0.138539 -0.051283 0.989028 0.000000 0.898999 0.412431 0.147314 0.000000 0.000000 0.000000 0.000000 1.000000 0.000 0.000 0.000 0.826 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 2 VECTS 0.450000 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 40 1 1.000 180 180 180 ISURF 0 0 0 0 TEX3P 1 0.00000E+00 1.00000E+00 SECTP 1 0.00000E+00 1.00000E+00 0.00000E+00 HKLPP 192 1 1.000 255 0 255 UCOLP 0 1 1.000 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