#VESTA_FORMAT_VERSION 3.3.0 MAGNETIC_CRYSTAL TITLE 5yOhtAoR GROUP 31 129 P_bmn2_1 PSPGR 62 1 P b n m SYMOP 0.000000 0.000000 0.000000 1 0 0 0 1 0 0 0 1 1 0.500000 0.250000 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 0.500000 0.250000 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 0.500000 0.750000 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 0.500000 0.750000 0.500000 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 0 0.250000 -0.875000 0.000000 0 -0 -1 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 16.218700 10.789600 7.503200 90.000000 90.000000 90.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 STRUC 1 La La1_1 0.3330 0.001200 0.009500 0.250000 4a m.. 0.000000 0.000000 0.000000 0.00 2 La La1_2 0.3330 0.998800 0.990500 0.750000 4a m.. 0.000000 0.000000 0.000000 0.00 3 Ca Ca1_1 0.6670 0.001200 0.009500 0.250000 4a m.. 0.000000 0.000000 0.000000 0.00 4 Ca Ca1_2 0.6670 0.998800 0.990500 0.750000 4a m.. 0.000000 0.000000 0.000000 0.00 5 La La2_1 0.3330 0.338700 0.009000 0.250000 4a m.. 0.000000 0.000000 0.000000 0.00 6 La La2_2 0.3330 0.661300 0.991000 0.750000 4a m.. 0.000000 0.000000 0.000000 0.00 7 Ca Ca2_1 0.6670 0.338700 0.009000 0.250000 4a m.. 0.000000 0.000000 0.000000 0.00 8 Ca Ca2_2 0.6670 0.661300 0.991000 0.750000 4a m.. 0.000000 0.000000 0.000000 0.00 9 La La3_1 0.3330 0.664000 0.014500 0.250000 4a m.. 0.000000 0.000000 0.000000 0.00 10 La La3_2 0.3330 0.336000 0.985500 0.750000 4a m.. 0.000000 0.000000 0.000000 0.00 11 Ca Ca3_1 0.6670 0.664000 0.014500 0.250000 4a m.. 0.000000 0.000000 0.000000 0.00 12 Ca Ca3_2 0.6670 0.336000 0.985500 0.750000 4a m.. 0.000000 0.000000 0.000000 0.00 13 Mn Mn1 1.0000 0.500000 0.000000 0.000000 8b 1 0.000000 0.000000 0.000000 0.00 14 Mn Mn2_1 1.0000 0.169700 0.498200 0.999800 8b 1 0.000000 0.000000 0.000000 0.00 15 Mn Mn2_2 1.0000 0.830300 0.501800 0.499800 8b 1 0.000000 0.000000 0.000000 0.00 16 O O1_1 1.0000 0.095500 0.135450 0.027100 8b 1 0.000000 0.000000 0.000000 0.00 17 O O1_2 1.0000 0.904500 0.864550 0.527100 8b 1 0.000000 0.000000 0.000000 0.00 18 O O2_1 1.0000 0.079600 0.385300 0.031500 8b 1 0.000000 0.000000 0.000000 0.00 19 O O2_2 1.0000 0.920400 0.614700 0.531500 8b 1 0.000000 0.000000 0.000000 0.00 20 O O3_1 1.0000 0.261600 0.106350 0.959500 8b 1 0.000000 0.000000 0.000000 0.00 21 O O3_2 1.0000 0.738400 0.893650 0.459500 8b 1 0.000000 0.000000 0.000000 0.00 22 O O4_1 1.0000 0.984600 0.241500 0.250000 4a m.. 0.000000 0.000000 0.000000 0.00 23 O O4_2 1.0000 0.015400 0.758500 0.750000 4a m.. 0.000000 0.000000 0.000000 0.00 24 O O5_1 1.0000 0.193100 0.493000 0.250000 4a m.. 0.000000 0.000000 0.000000 0.00 25 O O5_2 1.0000 0.806900 0.507000 0.750000 4a m.. 0.000000 0.000000 0.000000 0.00 26 O O6_1 1.0000 0.644800 0.254500 0.250000 4a m.. 0.000000 0.000000 0.000000 0.00 27 O O6_2 1.0000 0.355200 0.745500 0.750000 4a m.. 0.000000 0.000000 0.000000 0.00 0 0 0 0 0 0 0 THERI 0 1 La1_1 1.000000 2 La1_2 1.000000 3 Ca1_1 1.000000 4 Ca1_2 1.000000 5 La2_1 1.000000 6 La2_2 1.000000 7 Ca2_1 1.000000 8 Ca2_2 1.000000 9 La3_1 1.000000 10 La3_2 1.000000 11 Ca3_1 1.000000 12 Ca3_2 1.000000 13 Mn1 1.000000 14 Mn2_1 1.000000 15 Mn2_2 1.000000 16 O1_1 1.000000 17 O1_2 1.000000 18 O2_1 1.000000 19 O2_2 1.000000 20 O3_1 1.000000 21 O3_2 1.000000 22 O4_1 1.000000 23 O4_2 1.000000 24 O5_1 1.000000 25 O5_2 1.000000 26 O6_1 1.000000 27 O6_2 1.000000 0 0 0 SHAPE 0 0 0 0 0.000000 0 192 192 192 192 BOUND 0 1 -0.1 1.1 -0.1 1.1 0 0 0 0 0 SBOND 1 Mn O 0.00000 3.00000 0 1 1 0 1 0.250 1.000 180 180 180 0 0 0 0 SITET 1 La1_1 1.1000 90 196 73 90 196 73 10 0 2 La1_2 1.1000 90 196 73 90 196 73 10 0 3 Ca1_1 1.9700 90 150 189 90 150 189 10 0 4 Ca1_2 1.9700 90 150 189 90 150 189 10 0 5 La2_1 1.1000 90 196 73 90 196 73 10 0 6 La2_2 1.1000 90 196 73 90 196 73 10 0 7 Ca2_1 1.9700 90 150 189 90 150 189 10 0 8 Ca2_2 1.9700 90 150 189 90 150 189 10 0 9 La3_1 1.1000 90 196 73 90 196 73 10 0 10 La3_2 1.1000 90 196 73 90 196 73 10 0 11 Ca3_1 1.9700 90 150 189 90 150 189 10 0 12 Ca3_2 1.9700 90 150 189 90 150 189 10 0 13 Mn1 1.3700 168 8 158 168 8 158 10 0 14 Mn2_1 1.3700 168 8 158 168 8 158 10 0 15 Mn2_2 1.3700 168 8 158 168 8 158 10 0 16 O1_1 0.4000 254 3 0 254 3 0 10 0 17 O1_2 0.4000 254 3 0 254 3 0 10 0 18 O2_1 0.4000 254 3 0 254 3 0 10 0 19 O2_2 0.4000 254 3 0 254 3 0 10 0 20 O3_1 0.4000 254 3 0 254 3 0 10 0 21 O3_2 0.4000 254 3 0 254 3 0 10 0 22 O4_1 0.4000 254 3 0 254 3 0 10 0 23 O4_2 0.4000 254 3 0 254 3 0 10 0 24 O5_1 0.4000 254 3 0 254 3 0 10 0 25 O5_2 0.4000 254 3 0 254 3 0 10 0 26 O6_1 0.4000 254 3 0 254 3 0 10 0 27 O6_2 0.4000 254 3 0 254 3 0 10 0 0 0 0 0 0 0 VECTR 1 2.75000 -2.00000 0.00000 0 13 0 0 0 0 0 0 0 0 0 2 2.32000 1.18000 0.00000 0 14 0 0 0 0 0 0 0 0 0 3 1.63000 2.02000 0.00000 0 15 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 3 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 La 1.1000 90 196 73 90 196 73 10 2 Ca 1.9700 90 150 189 90 150 189 10 3 Mn 1.3700 168 8 158 168 8 158 10 4 O 0.4000 254 3 0 254 3 0 10 0 0 0 0 0 0 SCENE 0.999575 -0.016945 -0.023739 0.000000 0.010712 0.970323 -0.241577 0.000000 0.027128 0.241220 0.970091 0.000000 0.000000 0.000000 0.000000 1.000000 0.000 0.000 0.000 1.320 HBOND 0 2 STYLE DISPF 147551 MODEL 2 1 0 SURFS 0 1 1 SECTS 96 1 FORMS 0 1 ATOMS 0 0 1 BONDS 1 POLYS 2 VECTS 0.441129 FORMP 1 1.0 0 0 0 ATOMP 24 24 0 50 2.0 0 BONDP 1 16 0.250 1.000 180 180 180 POLYP 10 1 1.000 146 146 146 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