#VESTA_FORMAT_VERSION 3.3.0 MAGNETIC_CRYSTAL TITLE 5yOhtAoR GROUP 12 64 C_a2/m PSPGR 123 1 P 4/m m m 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 -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 0.500000 1 0 0 0 1 0 0 0 1 -1 0.000000 0.500000 0.000000 -1 0 0 0 1 0 0 0 -1 -1 0.000000 0.500000 0.000000 -1 0 0 0 -1 0 0 0 -1 -1 0.000000 0.500000 0.000000 1 0 0 0 -1 0 0 0 1 -1 0.000000 0.500000 0.500000 1 0 0 0 1 0 0 0 1 1 0.000000 0.500000 0.500000 -1 0 0 0 1 0 0 0 -1 1 0.000000 0.500000 0.500000 -1 0 0 0 -1 0 0 0 -1 1 0.000000 0.500000 0.500000 1 0 0 0 -1 0 0 0 1 1 0.000000 0.500000 0.000000 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 0.000000 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 0.500000 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 0.500000 0.000000 0.500000 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 0.500000 0.500000 -1 0 0 0 1 0 0 0 -1 -1 0.500000 0.500000 0.500000 -1 0 0 0 -1 0 0 0 -1 -1 0.500000 0.500000 0.500000 1 0 0 0 -1 0 0 0 1 -1 0.500000 0.500000 0.000000 1 0 0 0 1 0 0 0 1 1 0.500000 0.500000 0.000000 -1 0 0 0 1 0 0 0 -1 1 0.500000 0.500000 0.000000 -1 0 0 0 -1 0 0 0 -1 1 0.500000 0.500000 0.000000 1 0 0 0 -1 0 0 0 1 1 0.500000 0.500000 0.500000 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 0.500000 0.000000 0.000000 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 1 0 -2 0 1 0 1 0 0 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 7.750200 7.750200 15.358000 90.000000 90.000000 90.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 STRUC 1 Y Y1 1.0000 0.000000 0.000000 0.250000 8d 2'/m 0.000000 0.000000 0.000000 0.00 2 Ba Ba1 1.0000 0.000000 0.000000 0.000000 8a 2/m 0.000000 0.000000 0.000000 0.00 3 Cu Cu1 0.5000 0.250000 0.250000 0.142700 16n m' 0.000000 0.000000 0.000000 0.00 4 Fe Fe1 0.5000 0.250000 0.250000 0.126250 16n m' 0.000000 0.000000 0.000000 0.00 5 O O1 1.0000 0.250000 0.250000 0.000000 8h 2'/m' 0.000000 0.000000 0.000000 0.00 6 O O2_1 1.0000 0.000000 0.250000 0.157800 16n m' 0.000000 0.000000 0.000000 0.00 7 O O2_2 1.0000 0.250000 0.000000 0.157800 16m m 0.000000 0.000000 0.000000 0.00 0 0 0 0 0 0 0 THERI 0 1 Y1 1.000000 2 Ba1 1.000000 3 Cu1 1.000000 4 Fe1 1.000000 5 O1 1.000000 6 O2_1 1.000000 7 O2_2 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 Cu O 0.00000 2.47295 0 1 1 0 1 0.250 2.000 127 127 127 2 Fe O 0.00000 2.44693 0 1 1 0 1 0.250 2.000 127 127 127 0 0 0 0 SITET 1 Y1 1.2000 102 152 142 102 152 142 204 0 2 Ba1 1.3000 30 239 44 30 239 44 204 0 3 Cu1 1.1000 34 71 220 34 71 220 204 0 4 Fe1 1.1000 181 113 0 181 113 0 204 0 5 O1 0.6000 254 3 0 254 3 0 204 0 6 O2_1 0.6000 254 3 0 254 3 0 204 0 7 O2_2 0.6000 254 3 0 254 3 0 204 0 0 0 0 0 0 0 VECTR 1 0.00000 0.00000 0.00000 0 3 0 0 0 0 0 0 0 0 0 2 2.65000 0.00000 1.48000 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 VECTT 1 0.500 255 0 0 1 2 0.500 255 0 0 1 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 Y 1.2000 102 152 142 102 152 142 204 2 Ba 1.3000 30 239 44 30 239 44 204 3 Cu 1.1000 34 71 220 34 71 220 204 4 Fe 1.1000 181 113 0 181 113 0 204 5 O 0.6000 254 3 0 254 3 0 204 0 0 0 0 0 0 SCENE 0.998860 0.047228 -0.006879 0.000000 0.000621 0.131254 0.991349 0.000000 0.047722 -0.990223 0.131075 0.000000 0.000000 0.000000 0.000000 1.000000 0.000 0.000 0.000 0.957 HBOND 0 2 STYLE DISPF 37753794 MODEL 0 1 0 SURFS 0 1 1 SECTS 96 1 FORMS 0 1 ATOMS 0 0 1 BONDS 1 POLYS 1 VECTS 0.494189 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+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