#VESTA_FORMAT_VERSION 3.5.4 MAGNETIC_CRYSTAL TITLE "Fe2 W O6" GROUP 30 113 Pn'c2' PSPGR 60 1 P b c n SYMOP 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 0.500000 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 -1.0 -1.0 -1.0 0 0 0 0 0 0 0 0 0 TRANM 0 -0.250000 -0.000000 -0.000000 0 1 0 0 0 1 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 4.576000 16.766001 4.967000 90.000000 90.000000 90.000000 0.000000 0.000000 0.000000 0.000000 0.000000 0.000000 STRUC 1 Fe Fe1_1 1.0000 0.000000 0.056400 0.250000 2a ..2' 0.000000 0.000000 0.000000 0.00 2 Fe Fe1_2 1.0000 0.500000 0.443600 0.750000 2b ..2' 0.000000 0.000000 0.000000 0.00 3 Fe Fe2_1 1.0000 0.000000 0.724200 0.250000 2a ..2' 0.000000 0.000000 0.000000 0.00 4 Fe Fe2_2 1.0000 0.500000 0.775800 0.750000 2b ..2' 0.000000 0.000000 0.000000 0.00 5 W W1_1 1.0000 0.000000 0.387250 0.250000 2a ..2' 0.000000 0.000000 0.000000 0.00 6 W W1_2 1.0000 0.500000 0.112750 0.750000 2b ..2' 0.000000 0.000000 0.000000 0.00 7 O O1_1 1.0000 0.240000 0.040900 0.595800 4c 1 0.000000 0.000000 0.000000 0.00 8 O O1_2 1.0000 0.260000 0.459100 0.095800 4c 1 0.000000 0.000000 0.000000 0.00 9 O O2_1 1.0000 0.273400 0.127100 0.069200 4c 1 0.000000 0.000000 0.000000 0.00 10 O O2_2 1.0000 0.226600 0.372900 0.569200 4c 1 0.000000 0.000000 0.000000 0.00 11 O O3_1 1.0000 0.276000 0.203500 0.581700 4c 1 0.000000 0.000000 0.000000 0.00 12 O O3_2 1.0000 0.224000 0.296500 0.081700 4c 1 0.000000 0.000000 0.000000 0.00 0 0 0 0 0 0 0 THERI 1 1 Fe1_1 0.000000 2 Fe1_2 0.000000 3 Fe2_1 0.000000 4 Fe2_2 0.000000 5 W1_1 0.000000 6 W1_2 0.000000 7 O1_1 0.000000 8 O1_2 0.000000 9 O2_1 0.000000 10 O2_2 0.000000 11 O3_1 0.000000 12 O3_2 0.000000 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 Fe O 0.00000 2.44693 0 1 1 0 1 0.250 2.000 127 127 127 2 W O 0.00000 2.20102 0 1 1 0 1 0.250 2.000 127 127 127 0 0 0 0 SITET 1 Fe1_1 1.2600 181 113 0 181 113 0 60 0 2 Fe1_2 1.2600 181 113 0 181 113 0 60 0 3 Fe2_1 1.2600 181 113 0 181 113 0 60 0 4 Fe2_2 1.2600 181 113 0 181 113 0 60 0 5 W1_1 1.1000 141 138 127 141 138 127 60 0 6 W1_2 1.1000 141 138 127 141 138 127 60 0 7 O1_1 0.4000 254 3 0 254 3 0 60 0 8 O1_2 0.4000 254 3 0 254 3 0 60 0 9 O2_1 0.4000 254 3 0 254 3 0 60 0 10 O2_2 0.4000 254 3 0 254 3 0 60 0 11 O3_1 0.4000 254 3 0 254 3 0 60 0 12 O3_2 0.4000 254 3 0 254 3 0 60 0 0 0 0 0 0 0 VECTR 1 1.36000 0.00000 3.12000 0 1 0 0 0 0 0 0 0 0 0 2 -1.36000 0.00000 -3.12000 0 2 0 0 0 0 0 0 0 0 0 3 -1.36000 0.00000 3.12000 0 3 0 0 0 0 0 0 0 0 0 4 1.36000 0.00000 -3.12000 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 3 0.500 255 0 0 1 4 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 Fe 1.2600 181 113 0 181 113 0 60 2 W 1.1000 141 138 127 141 138 127 60 3 O 0.4000 254 3 0 254 3 0 60 0 0 0 0 0 0 SCENE -0.303045 0.008307 -0.952940 0.000000 -0.164074 0.984575 0.060760 0.000000 0.938746 0.174766 -0.297007 0.000000 0.000000 0.000000 0.000000 1.000000 0.000 0.000 0.000 1.000 HBOND 0 2 STYLE DISPF 37753794 MODEL 2 1 0 SURFS 0 1 1 SECTS 32 1 FORMS 0 1 ATOMS 0 0 1 BONDS 1 POLYS 2 VECTS 0.400000 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 60 1 1.000 243 243 243 ISURF 0 0 0 0 TEX3P 1 0.00000E+00 1.00000E+00 SECTP 1 0.00000E+00 1.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 CONTR 0.1 -1 1 1 10 -1 2 5 2 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 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 SECCL 0 TEXCL 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