# generated using pymatgen data_Ca18TmCd8N7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.35356660 _cell_length_b 10.35577407 _cell_length_c 10.35619293 _cell_angle_alpha 60.00394186 _cell_angle_beta 59.99289286 _cell_angle_gamma 59.99281658 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ca18TmCd8N7 _chemical_formula_sum 'Ca18 Tm1 Cd8 N7' _cell_volume 785.09769800 _cell_formula_units_Z 1 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 '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 Ca Ca0 1 0.17200494 0.49999026 0.82800689 1.0 Ca Ca1 1 0.49999260 0.82802162 0.17202224 1.0 Ca Ca2 1 0.82799268 0.17195895 0.50001903 1.0 Ca Ca3 1 0.16627472 0.83375878 0.16623495 1.0 Ca Ca4 1 0.82799506 0.50000974 0.17199311 1.0 Ca Ca5 1 0.17200732 0.82804105 0.49998097 1.0 Ca Ca6 1 0.16624804 0.16625029 0.83378135 1.0 Ca Ca7 1 0.17201822 0.49994433 0.49995889 1.0 Ca Ca8 1 0.83375196 0.83374971 0.16621865 1.0 Ca Ca9 1 0.83372528 0.16624122 0.83376505 1.0 Ca Ca10 1 0.50001394 0.82790167 0.50002182 1.0 Ca Ca11 1 0.49997984 0.49994661 0.17204600 1.0 Ca Ca12 1 0.16622908 0.83373093 0.83376893 1.0 Ca Ca13 1 0.50000740 0.17197838 0.82797776 1.0 Ca Ca14 1 0.49998606 0.17209833 0.49997818 1.0 Ca Ca15 1 0.82798178 0.50005567 0.50004111 1.0 Ca Ca16 1 0.83377092 0.16626907 0.16623107 1.0 Ca Ca17 1 0.50002016 0.50005339 0.82795400 1.0 Tm Tm18 1 0.50000000 0.50000000 0.50000000 1.0 Cd Cd19 1 0.17540534 0.17541592 0.47378435 1.0 Cd Cd20 1 0.82457466 0.52617037 0.82460610 1.0 Cd Cd21 1 0.47411767 0.17525334 0.17522329 1.0 Cd Cd22 1 0.17542534 0.47382963 0.17539390 1.0 Cd Cd23 1 0.52588233 0.82474666 0.82477671 1.0 Cd Cd24 1 0.17541726 0.17531896 0.17532179 1.0 Cd Cd25 1 0.82458274 0.82468104 0.82467821 1.0 Cd Cd26 1 0.82459466 0.82458408 0.52621565 1.0 N N27 1 0.66634475 0.33368614 0.66629062 1.0 N N28 1 0.66634288 0.33367776 0.33367498 1.0 N N29 1 0.33365712 0.66632224 0.66632502 1.0 N N30 1 0.33365525 0.66631386 0.33370938 1.0 N N31 1 0.33364984 0.33369208 0.66632465 1.0 N N32 1 0.66635016 0.66630792 0.33367535 1.0 N N33 1 0.00000000 0.00000000 0.00000000 1.0