# generated using pymatgen data_AsS _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.45746800 _cell_length_b 10.31770359 _cell_length_c 19.36179024 _cell_angle_alpha 92.13352262 _cell_angle_beta 91.59886940 _cell_angle_gamma 107.00966530 _symmetry_Int_Tables_number 1 _chemical_formula_structural AsS _chemical_formula_sum 'As24 S24' _cell_volume 1613.18256753 _cell_formula_units_Z 24 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 As As0 1 0.06509200 0.30918600 0.47569100 1.0 As As1 1 0.77000300 0.36662700 0.29008600 1.0 As As2 1 0.29158200 0.00097900 0.99345700 1.0 As As3 1 0.67682900 0.98330100 0.31535900 1.0 As As4 1 0.32774800 0.48169800 0.65139900 1.0 As As5 1 0.50694600 0.65195300 0.22314500 1.0 As As6 1 0.05332600 0.78783500 0.01014900 1.0 As As7 1 0.48080600 0.36146100 0.78339800 1.0 As As8 1 0.75494300 0.85046800 0.21063500 1.0 As As9 1 0.29976600 0.51901200 0.83147400 1.0 As As10 1 0.68042000 0.47890900 0.18323500 1.0 As As11 1 0.75394100 0.50630500 0.49568700 1.0 As As12 1 0.33855300 0.98975400 0.86024000 1.0 As As13 1 0.31804300 0.01091200 0.68191400 1.0 As As14 1 0.99386600 0.71121000 0.52661400 1.0 As As15 1 0.24299300 0.14856500 0.78685900 1.0 As As16 1 0.66502600 0.00717800 0.13374800 1.0 As As17 1 0.67489700 0.52428900 0.36834400 1.0 As As18 1 0.72094100 0.97880500 0.00528400 1.0 As As19 1 0.52836100 0.16365100 0.26946500 1.0 As As20 1 0.31921500 0.49852800 0.51903600 1.0 As As21 1 0.95997400 0.18489600 0.98500400 1.0 As As22 1 0.46447300 0.83522000 0.72469500 1.0 As As23 1 0.21482600 0.63473700 0.72499700 1.0 S S24 1 0.07433900 0.83817400 0.83499900 1.0 S S25 1 0.92453900 0.10164600 0.33975200 1.0 S S26 1 0.91880300 0.69247300 0.34713400 1.0 S S27 1 0.79641100 0.79731400 0.97358700 1.0 S S28 1 0.24787800 0.68456400 0.48261200 1.0 S S29 1 0.61065600 0.20419000 0.92611800 1.0 S S30 1 0.45238500 0.84735400 0.53113100 1.0 S S31 1 0.07342600 0.35481800 0.83195000 1.0 S S32 1 0.08804000 0.69546400 0.90278600 1.0 S S33 1 0.91476400 0.62749600 0.17314000 1.0 S S34 1 0.83223800 0.32943700 0.52686100 1.0 S S35 1 0.35042500 0.14503600 0.35683000 1.0 S S36 1 0.34309300 0.62613500 0.12501800 1.0 S S37 1 0.12170600 0.19392500 0.56916600 1.0 S S38 1 0.20866400 0.17377100 0.03269100 1.0 S S39 1 0.90518500 0.29579100 0.08345000 1.0 S S40 1 0.93781700 0.81942500 0.43314100 1.0 S S41 1 0.06430900 0.89613600 0.66625800 1.0 S S42 1 0.91534100 0.17358700 0.16268400 1.0 S S43 1 0.40665700 0.77761200 0.06182800 1.0 S S44 1 0.08902900 0.30333600 0.65472500 1.0 S S45 1 0.42589400 0.27331200 0.43831200 1.0 S S46 1 0.64262800 0.37640200 0.88101300 1.0 S S47 1 0.55320400 0.78712100 0.61489900 1.0