#VESTA_FORMAT_VERSION 3.5.4 MAGNETIC_CRYSTAL TITLE "C7 H14 Cl4 Fe N" GROUP 19 27 P2_1'2_1'2_1 PSPGR 61 1 P b c a SYMOP 0.000000 0.000000 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 0.000000 0.500000 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 -1.0 -1.0 -1.0 0 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 13.054700 12.567100 14.600000 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 0.283130 0.042570 0.249110 4a 1 0.000000 0.000000 0.000000 0.00 2 Fe Fe1_2 1.0000 0.716870 0.957430 0.750890 4a 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 0 0 0 SHAPE 0 0 0 0 0.000000 0 192 192 192 192 BOUND 0 1 -0.2 1.2 0 1 0 0 0 0 0 SBOND 1 C C 0.00000 1.89002 0 2 0 0 0 0.250 2.000 127 127 127 2 C N 0.00000 1.79202 0 2 1 0 0 0.250 2.000 127 127 127 3 C H 0.00000 1.40000 0 1 0 0 0 0.250 2.000 127 127 127 4 Fe Cl 0.00000 2.86293 0 1 1 0 0 0.250 2.000 127 127 127 5 H N 0.00000 1.20000 0 1 0 0 0 0.250 2.000 127 127 127 6 H C 0.00000 1.60000 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 0 204 0 2 Fe1_2 1.2600 181 113 0 181 113 0 204 0 0 0 0 0 0 0 VECTR 1 -1.23000 -3.50000 0.05000 0 1 0 0 0 0 0 0 0 0 0 2 1.81000 -3.20000 0.05000 0 2 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 Fe 1.2600 181 113 0 181 113 0 204 0 0 0 0 0 0 SCENE -0.146573 0.989168 0.007979 0.000000 -0.142629 -0.029115 0.989348 0.000000 0.978863 0.143874 0.145351 0.000000 0.000000 0.000000 0.000000 1.000000 0.000 0.000 0.000 1.179 HBOND 0 2 STYLE DISPF 37753794 MODEL 0 1 0 SURFS 0 1 1 SECTS 32 1 FORMS 0 1 ATOMS 0 0 1 BONDS 0 POLYS 1 VECTS 0.404294 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 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