# generated using pymatgen data_NiMo8P3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.80387900 _cell_length_b 7.35119726 _cell_length_c 20.86460884 _cell_angle_alpha 87.32803526 _cell_angle_beta 83.82564756 _cell_angle_gamma 71.06597952 _symmetry_Int_Tables_number 1 _chemical_formula_structural NiMo8P3 _chemical_formula_sum 'Ni4 Mo32 P12' _cell_volume 692.85446919 _cell_formula_units_Z 4 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 0.44150200 0.90299800 0.16256300 1.0 Ni Ni1 1 0.78714800 0.89392800 0.49468500 1.0 Ni Ni2 1 0.12227800 0.89301800 0.82790800 1.0 Ni Ni3 1 0.84363200 0.09358000 0.17025200 1.0 Mo Mo4 1 0.04917200 0.68823400 0.16482200 1.0 Mo Mo5 1 0.38679600 0.68320300 0.49795900 1.0 Mo Mo6 1 0.72026100 0.68360900 0.83136000 1.0 Mo Mo7 1 0.23689100 0.31112300 0.16860700 1.0 Mo Mo8 1 0.58310700 0.30837800 0.50190800 1.0 Mo Mo9 1 0.91341400 0.30940900 0.83576500 1.0 Mo Mo10 1 0.72053700 0.49461500 0.10589000 1.0 Mo Mo11 1 0.04899500 0.49667100 0.43807100 1.0 Mo Mo12 1 0.38474800 0.49603300 0.77151600 1.0 Mo Mo13 1 0.65392000 0.50531800 0.22785200 1.0 Mo Mo14 1 0.98416900 0.50489900 0.56173200 1.0 Mo Mo15 1 0.31422300 0.50579700 0.89481500 1.0 Mo Mo16 1 0.68081600 0.86037800 0.28091800 1.0 Mo Mo17 1 0.00906500 0.85913100 0.61611700 1.0 Mo Mo18 1 0.33962500 0.85914100 0.95005300 1.0 Mo Mo19 1 0.15367500 0.13721300 0.05311000 1.0 Mo Mo20 1 0.48277400 0.14315600 0.38245200 1.0 Mo Mo21 1 0.81570600 0.14077700 0.71754100 1.0 Mo Mo22 1 0.80448400 0.84855300 0.04889600 1.0 Mo Mo23 1 0.13815600 0.85257900 0.38049500 1.0 Mo Mo24 1 0.47167300 0.85194500 0.71417000 1.0 Mo Mo25 1 0.03455500 0.15147400 0.28435400 1.0 Mo Mo26 1 0.35745700 0.15401900 0.62197100 1.0 Mo Mo27 1 0.68998700 0.15511700 0.95681500 1.0 Mo Mo28 1 0.18862600 0.08624900 0.50418700 1.0 Mo Mo29 1 0.52195600 0.08585400 0.83860300 1.0 Mo Mo30 1 0.25303900 0.48974000 0.03103600 1.0 Mo Mo31 1 0.58082000 0.49499200 0.36601600 1.0 Mo Mo32 1 0.91846400 0.49470600 0.69855700 1.0 Mo Mo33 1 0.10922200 0.50864200 0.30128000 1.0 Mo Mo34 1 0.44126100 0.51257600 0.63335400 1.0 Mo Mo35 1 0.77006700 0.51457800 0.96681500 1.0 P P36 1 0.22782500 0.80168300 0.25841900 1.0 P P37 1 0.55597500 0.80926400 0.58933400 1.0 P P38 1 0.88568600 0.81209100 0.92294500 1.0 P P39 1 0.62031100 0.19702200 0.07656900 1.0 P P40 1 0.94646200 0.20184500 0.40471500 1.0 P P41 1 0.27721700 0.20204300 0.73999800 1.0 P P42 1 0.33486300 0.78156700 0.06871900 1.0 P P43 1 0.66630900 0.78825500 0.40184100 1.0 P P44 1 0.00024800 0.78615300 0.73559300 1.0 P P45 1 0.52016400 0.21546800 0.26418700 1.0 P P46 1 0.84041600 0.21642500 0.60039700 1.0 P P47 1 0.17230600 0.21655300 0.93484100 1.0