# generated using pymatgen data_Nd3MnGaS7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.08139956 _cell_length_b 10.08139956 _cell_length_c 6.06296700 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999713 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3MnGaS7 _chemical_formula_sum 'Nd6 Mn2 Ga2 S14' _cell_volume 533.65121699 _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 Nd Nd0 1 0.76556700 0.14020300 0.24848600 1.0 Nd Nd1 1 0.37463600 0.23443300 0.24848600 1.0 Nd Nd2 1 0.85979700 0.62536400 0.24848600 1.0 Nd Nd3 1 0.23443300 0.85979700 0.74848600 1.0 Nd Nd4 1 0.62536400 0.76556700 0.74848600 1.0 Nd Nd5 1 0.14020300 0.37463600 0.74848600 1.0 Mn Mn6 1 0.00000000 0.00000000 0.02382700 1.0 Mn Mn7 1 0.00000000 0.00000000 0.52382700 1.0 Ga Ga8 1 0.66666700 0.33333300 0.67090000 1.0 Ga Ga9 1 0.33333300 0.66666700 0.17090000 1.0 S S10 1 0.85221200 0.09026600 0.78548100 1.0 S S11 1 0.23805500 0.14778800 0.78548100 1.0 S S12 1 0.90973400 0.76194500 0.78548100 1.0 S S13 1 0.14778800 0.90973400 0.28548100 1.0 S S14 1 0.76194500 0.85221200 0.28548100 1.0 S S15 1 0.09026600 0.23805500 0.28548100 1.0 S S16 1 0.90356400 0.41986000 0.51654300 1.0 S S17 1 0.51629600 0.09643600 0.51654300 1.0 S S18 1 0.58014000 0.48370400 0.51654300 1.0 S S19 1 0.09643600 0.58014000 0.01654300 1.0 S S20 1 0.48370400 0.90356400 0.01654300 1.0 S S21 1 0.41986000 0.51629600 0.01654300 1.0 S S22 1 0.66666700 0.33333300 0.04177900 1.0 S S23 1 0.33333300 0.66666700 0.54177900 1.0