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data_image0 | |
_chemical_formula_structural Cr16Fe16Ni16Sn16 | |
_chemical_formula_sum "Cr16 Fe16 Ni16 Sn16" | |
_cell_length_a 6.28036836238552 | |
_cell_length_b 9.729504828593834 | |
_cell_length_c 16.851996690897195 | |
_cell_angle_alpha 95.52183275573677 | |
_cell_angle_beta 98.573104985915 | |
_cell_angle_gamma 97.41755573965753 | |
_space_group_name_H-M_alt "P 1" | |
_space_group_IT_number 1 | |
loop_ | |
_space_group_symop_operation_xyz | |
'x, y, z' | |
loop_ | |
_atom_site_type_symbol | |
_atom_site_label | |
_atom_site_symmetry_multiplicity | |
_atom_site_fract_x | |
_atom_site_fract_y | |
_atom_site_fract_z | |
_atom_site_occupancy | |
Cr Cr1 1.0 0.0 0.0 0.0 1.0000 | |
Cr Cr2 1.0 0.37500000000000006 0.25 0.3125 1.0000 | |
Cr Cr3 1.0 0.06250000000000003 0.375 0.71875 1.0000 | |
Cr Cr4 1.0 0.25 0.5 0.875 1.0000 | |
Cr Cr5 1.0 0.5625 0.37499999999999994 0.96875 1.0000 | |
Cr Cr6 1.0 0.12499999999999997 0.7499999999999999 0.4375 1.0000 | |
Cr Cr7 1.0 0.6875000000000001 0.12499999999999986 0.9062500000000001 1.0000 | |
Cr Cr8 1.0 0.37500000000000006 0.75 0.31250000000000006 1.0000 | |
Cr Cr9 1.0 0.7500000000000001 0.0 0.625 1.0000 | |
Cr Cr10 1.0 0.3125 0.375 0.09375000000000003 1.0000 | |
Cr Cr11 1.0 0.6875000000000001 0.625 0.40625 1.0000 | |
Cr Cr12 1.0 0.8749999999999999 0.7499999999999998 0.5625 1.0000 | |
Cr Cr13 1.0 0.625 0.24999999999999992 0.1875 1.0000 | |
Cr Cr14 1.0 0.125 0.25 0.4375 1.0000 | |
Cr Cr15 1.0 0.3125 0.375 0.59375 1.0000 | |
Cr Cr16 1.0 0.43750000000000006 0.125 0.53125 1.0000 | |
Fe Fe1 1.0 0.18750000000000003 0.125 0.15625 1.0000 | |
Fe Fe2 1.0 0.5625000000000001 0.375 0.46875000000000006 1.0000 | |
Fe Fe3 1.0 0.7500000000000001 0.5 0.625 1.0000 | |
Fe Fe4 1.0 0.9375000000000001 0.625 0.7812500000000001 1.0000 | |
Fe Fe5 1.0 0.12499999999999997 0.7499999999999998 0.9375000000000001 1.0000 | |
Fe Fe6 1.0 0.6875000000000001 0.12499999999999996 0.40625 1.0000 | |
Fe Fe7 1.0 0.7499999999999999 0.49999999999999994 0.12499999999999997 1.0000 | |
Fe Fe8 1.0 0.3125 0.8749999999999999 0.59375 1.0000 | |
Fe Fe9 1.0 0.8750000000000001 0.25 0.0625 1.0000 | |
Fe Fe10 1.0 0.8125000000000001 0.8750000000000001 0.84375 1.0000 | |
Fe Fe11 1.0 0.18750000000000003 0.625 0.15624999999999997 1.0000 | |
Fe Fe12 1.0 0.1250000000000001 0.25 0.9375000000000001 1.0000 | |
Fe Fe13 1.0 0.5 0.5 0.25 1.0000 | |
Fe Fe14 1.0 0.8125 0.375 0.34375000000000006 1.0000 | |
Fe Fe15 1.0 0.7500000000000001 0.0 0.125 1.0000 | |
Fe Fe16 1.0 0.8750000000000001 0.7499999999999999 0.06250000000000001 1.0000 | |
Ni Ni1 1.0 0.3125000000000001 0.8750000000000001 0.09375 1.0000 | |
Ni Ni2 1.0 0.5 0.0 0.25 1.0000 | |
Ni Ni3 1.0 0.43750000000000006 0.625 0.031249999999999976 1.0000 | |
Ni Ni4 1.0 0.625 0.75 0.18750000000000006 1.0000 | |
Ni Ni5 1.0 0.18750000000000003 0.12499999999999996 0.65625 1.0000 | |
Ni Ni6 1.0 0.25 0.5 0.375 1.0000 | |
Ni Ni7 1.0 0.625 0.7499999999999998 0.6875000000000001 1.0000 | |
Ni Ni8 1.0 0.0 0.5 0.0 1.0000 | |
Ni Ni9 1.0 0.9375000000000001 0.12499999999999996 0.78125 1.0000 | |
Ni Ni10 1.0 0.43750000000000006 0.125 0.03125 1.0000 | |
Ni Ni11 1.0 0.18750000000000003 0.625 0.65625 1.0000 | |
Ni Ni12 1.0 0.49999999999999994 0.49999999999999994 0.75 1.0000 | |
Ni Ni13 1.0 0.6875000000000002 0.6250000000000001 0.9062500000000001 1.0000 | |
Ni Ni14 1.0 0.06249999999999995 0.8749999999999999 0.21875 1.0000 | |
Ni Ni15 1.0 0.625 0.24999999999999992 0.6875000000000001 1.0000 | |
Ni Ni16 1.0 0.8125 0.37499999999999994 0.84375 1.0000 | |
Sn Sn1 1.0 0.8750000000000001 0.25000000000000006 0.5625000000000001 1.0000 | |
Sn Sn2 1.0 0.8125 0.8749999999999999 0.34375 1.0000 | |
Sn Sn3 1.0 0.0 0.0 0.5 1.0000 | |
Sn Sn4 1.0 0.37500000000000006 0.25 0.8125 1.0000 | |
Sn Sn5 1.0 0.9375000000000001 0.625 0.28124999999999994 1.0000 | |
Sn Sn6 1.0 0.5 0.0 0.7500000000000001 1.0000 | |
Sn Sn7 1.0 0.062499999999999986 0.37499999999999994 0.21875 1.0000 | |
Sn Sn8 1.0 0.43749999999999994 0.6249999999999999 0.53125 1.0000 | |
Sn Sn9 1.0 0.5625000000000002 0.8750000000000001 0.46875000000000006 1.0000 | |
Sn Sn10 1.0 0.06250000000000003 0.8750000000000001 0.71875 1.0000 | |
Sn Sn11 1.0 0.25 0.9999999999999999 0.8750000000000001 1.0000 | |
Sn Sn12 1.0 0.0 0.5 0.5 1.0000 | |
Sn Sn13 1.0 0.3750000000000001 0.7499999999999999 0.8125000000000001 1.0000 | |
Sn Sn14 1.0 0.5625 0.8749999999999999 0.96875 1.0000 | |
Sn Sn15 1.0 0.9375000000000001 0.12499999999999999 0.28125000000000006 1.0000 | |
Sn Sn16 1.0 0.25 0.0 0.37500000000000006 1.0000 | |