# generated using pymatgen data_Nd2S4N2O17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.03128700 _cell_length_b 7.03946387 _cell_length_c 9.79762592 _cell_angle_alpha 99.30384419 _cell_angle_beta 108.23628234 _cell_angle_gamma 106.33741635 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2S4N2O17 _chemical_formula_sum 'Nd2 S4 N2 O17' _cell_volume 425.08265541 _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 Nd Nd0 1 0.90489800 0.01655000 0.63210100 1.0 Nd Nd1 1 0.06603900 0.67319700 0.13443200 1.0 S S2 1 0.36667200 0.07862600 0.50524100 1.0 S S3 1 0.09038100 0.58603300 0.74930900 1.0 S S4 1 0.04596900 0.12211500 0.97864900 1.0 S S5 1 0.66989800 0.80095100 0.27544100 1.0 N N6 1 0.40439500 0.25182800 0.41406500 1.0 N N7 1 0.34863100 0.63906500 0.82549900 1.0 O O8 1 0.23595100 0.12676700 0.58685100 1.0 O O9 1 0.57898100 0.09792400 0.60712800 1.0 O O10 1 0.25523400 0.87693500 0.39321300 1.0 O O11 1 0.00175900 0.38800400 0.63660500 1.0 O O12 1 0.06402200 0.75473300 0.68379100 1.0 O O13 1 0.00836100 0.57855900 0.87059300 1.0 O O14 1 0.13419200 0.00438400 0.07775200 1.0 O O15 1 0.83142600 0.99282400 0.86300900 1.0 O O16 1 0.03302500 0.30402700 0.07787700 1.0 O O17 1 0.18390700 0.20029900 0.89683300 1.0 O O18 1 0.43695900 0.71145700 0.19090100 1.0 O O19 1 0.73824100 0.01742900 0.36415800 1.0 O O20 1 0.74086500 0.68616200 0.39234100 1.0 O O21 1 0.78359200 0.77946200 0.17365200 1.0 O O22 1 0.73416400 0.37357300 0.99136900 1.0 O O23 1 0.60003000 0.69372200 0.57075800 1.0 O O24 1 0.91574500 0.47205700 0.29642100 1.0