# generated using pymatgen data_U4S2N4O21 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.44862700 _cell_length_b 8.47046495 _cell_length_c 17.86672782 _cell_angle_alpha 97.13911496 _cell_angle_beta 97.17202902 _cell_angle_gamma 117.55995951 _symmetry_Int_Tables_number 1 _chemical_formula_structural U4S2N4O21 _chemical_formula_sum 'U8 S4 N8 O42' _cell_volume 1100.30395072 _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 U U0 1 0.89795700 0.43994900 0.33576000 1.0 U U1 1 0.44041700 0.89748200 0.33598200 1.0 U U2 1 0.10475200 0.56262200 0.66524300 1.0 U U3 1 0.56260600 0.10506100 0.66512300 1.0 U U4 1 0.10476200 0.56163800 0.16692400 1.0 U U5 1 0.56336800 0.10271800 0.16688700 1.0 U U6 1 0.89840900 0.43859900 0.83413300 1.0 U U7 1 0.43919100 0.89827500 0.83384100 1.0 S S8 1 0.25688000 0.74494600 0.00048700 1.0 S S9 1 0.74660700 0.25502200 0.00052100 1.0 S S10 1 0.74614400 0.25438000 0.50039700 1.0 S S11 1 0.25407900 0.74684200 0.50069700 1.0 N N12 1 0.16150500 0.16455700 0.47888500 1.0 N N13 1 0.84617000 0.84031100 0.50457700 1.0 N N14 1 0.73208800 0.72875700 0.00212700 1.0 N N15 1 0.26920700 0.27135300 0.99825100 1.0 N N16 1 0.62295700 0.62212900 0.17255300 1.0 N N17 1 0.37895700 0.37903900 0.82743400 1.0 N N18 1 0.36915100 0.36770800 0.32397400 1.0 N N19 1 0.63280700 0.63347400 0.67432400 1.0 O O20 1 0.75503400 0.38197500 0.44914000 1.0 O O21 1 0.38222600 0.75608400 0.44959000 1.0 O O22 1 0.24469700 0.61653600 0.55057900 1.0 O O23 1 0.61540800 0.24450600 0.55024200 1.0 O O24 1 0.38672800 0.75627300 0.94959200 1.0 O O25 1 0.75669400 0.38431500 0.94966100 1.0 O O26 1 0.61657700 0.24409000 0.05128900 1.0 O O27 1 0.24721600 0.61596700 0.05145600 1.0 O O28 1 0.15260500 0.64277000 0.29351300 1.0 O O29 1 0.64396500 0.15129800 0.29339900 1.0 O O30 1 0.85058600 0.35890800 0.70750600 1.0 O O31 1 0.35847000 0.85085300 0.70740700 1.0 O O32 1 0.31758500 0.92486800 0.05039900 1.0 O O33 1 0.92698500 0.31610800 0.05051900 1.0 O O34 1 0.68565400 0.07515500 0.95051900 1.0 O O35 1 0.07632700 0.68341300 0.95054400 1.0 O O36 1 0.92738500 0.31380800 0.55035400 1.0 O O37 1 0.31275200 0.92735400 0.55052200 1.0 O O38 1 0.07188900 0.69071100 0.45197700 1.0 O O39 1 0.69058400 0.07287300 0.45188600 1.0 O O40 1 0.85259300 0.35828900 0.20877400 1.0 O O41 1 0.35974900 0.85043800 0.20874100 1.0 O O42 1 0.15113200 0.64425500 0.79238700 1.0 O O43 1 0.64431200 0.15029400 0.79241300 1.0 O O44 1 0.78321200 0.57072100 0.31907600 1.0 O O45 1 0.57270600 0.78379700 0.32050900 1.0 O O46 1 0.22142600 0.43364300 0.68213200 1.0 O O47 1 0.43259300 0.22067300 0.68192700 1.0 O O48 1 0.22426300 0.43517700 0.18328900 1.0 O O49 1 0.43630600 0.22173200 0.18280200 1.0 O O50 1 0.77810200 0.56430900 0.81796200 1.0 O O51 1 0.56531000 0.77847500 0.81747100 1.0 O O52 1 0.97841500 0.67247600 0.13434200 1.0 O O53 1 0.67520500 0.97716400 0.13477300 1.0 O O54 1 0.02621300 0.32854700 0.86595700 1.0 O O55 1 0.32897700 0.02514300 0.86649500 1.0 O O56 1 0.02310000 0.32604800 0.36740700 1.0 O O57 1 0.32528200 0.02177600 0.36699100 1.0 O O58 1 0.97944700 0.67628400 0.63360800 1.0 O O59 1 0.67660500 0.98013900 0.63353600 1.0 O O60 1 0.04971500 0.05700400 0.43084600 1.0 O O61 1 0.93271500 0.92896300 0.56195300 1.0