# generated using pymatgen data_Ni4Mo6As2C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.75473668 _cell_length_b 7.75473595 _cell_length_c 7.75473666 _cell_angle_alpha 59.99999279 _cell_angle_beta 59.99999591 _cell_angle_gamma 59.99999658 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ni4Mo6As2C _chemical_formula_sum 'Ni8 Mo12 As4 C2' _cell_volume 329.75096761 _cell_formula_units_Z 2 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 Ni Ni0 1 0.33228671 0.33228671 0.00314088 1.0 Ni Ni1 1 0.33228671 0.33228671 0.33228671 1.0 Ni Ni2 1 0.24685912 0.91771329 0.91771329 1.0 Ni Ni3 1 0.91771329 0.91771329 0.91771329 1.0 Ni Ni4 1 0.00314088 0.33228671 0.33228671 1.0 Ni Ni5 1 0.33228671 0.00314088 0.33228671 1.0 Ni Ni6 1 0.91771329 0.91771329 0.24685912 1.0 Ni Ni7 1 0.91771329 0.24685912 0.91771329 1.0 Mo Mo8 1 0.30859942 0.69140058 0.69140058 1.0 Mo Mo9 1 0.69140058 0.69140058 0.30859942 1.0 Mo Mo10 1 0.69140058 0.30859942 0.69140058 1.0 Mo Mo11 1 0.30859942 0.69140058 0.30859942 1.0 Mo Mo12 1 0.55859942 0.94140058 0.55859942 1.0 Mo Mo13 1 0.55859942 0.94140058 0.94140058 1.0 Mo Mo14 1 0.94140058 0.55859942 0.55859942 1.0 Mo Mo15 1 0.94140058 0.55859942 0.94140058 1.0 Mo Mo16 1 0.30859942 0.30859942 0.69140058 1.0 Mo Mo17 1 0.55859942 0.55859942 0.94140058 1.0 Mo Mo18 1 0.94140058 0.94140058 0.55859942 1.0 Mo Mo19 1 0.69140058 0.30859942 0.30859942 1.0 As As20 1 0.12500000 0.62500000 0.12500000 1.0 As As21 1 0.12500000 0.12500000 0.62500000 1.0 As As22 1 0.62500000 0.12500000 0.12500000 1.0 As As23 1 0.12500000 0.12500000 0.12500000 1.0 C C24 1 0.50000000 0.50000000 0.50000000 1.0 C C25 1 0.75000000 0.75000000 0.75000000 1.0