# generated using pymatgen data_U5(B12Mo5)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.09938300 _cell_length_b 14.64970400 _cell_length_c 17.99326100 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural U5(B12Mo5)2 _chemical_formula_sum 'U10 B48 Mo20' _cell_volume 816.98479900 _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 0.00000000 0.52534400 0.38613500 1.0 U U1 1 0.50000000 0.02208000 0.50000000 1.0 U U2 1 0.50000000 0.82394600 0.24500900 1.0 U U3 1 0.00000000 0.97792000 0.00000000 1.0 U U4 1 0.50000000 0.82394600 0.75499100 1.0 U U5 1 0.50000000 0.47465600 0.11386500 1.0 U U6 1 0.00000000 0.17605400 0.74500900 1.0 U U7 1 0.50000000 0.47465600 0.88613500 1.0 U U8 1 0.00000000 0.17605400 0.25499100 1.0 U U9 1 0.00000000 0.52534400 0.61386500 1.0 B B10 1 0.50000000 0.18834900 0.86859200 1.0 B B11 1 0.00000000 0.16752700 0.50000000 1.0 B B12 1 0.50000000 0.52775400 0.26374300 1.0 B B13 1 0.00000000 0.11094000 0.40587900 1.0 B B14 1 0.50000000 0.18834900 0.13140800 1.0 B B15 1 0.00000000 0.91367400 0.14467700 1.0 B B16 1 0.00000000 0.61404100 0.08727400 1.0 B B17 1 0.00000000 0.35892200 0.80717800 1.0 B B18 1 0.50000000 0.38595900 0.58727400 1.0 B B19 1 0.00000000 0.33681900 0.62529200 1.0 B B20 1 0.00000000 0.33681900 0.37470800 1.0 B B21 1 0.50000000 0.29676100 0.17690300 1.0 B B22 1 0.00000000 0.13543100 0.09913800 1.0 B B23 1 0.00000000 0.53999000 0.00000000 1.0 B B24 1 0.00000000 0.97856800 0.22951500 1.0 B B25 1 0.00000000 0.47224600 0.23625700 1.0 B B26 1 0.50000000 0.08632600 0.35532300 1.0 B B27 1 0.50000000 0.64107800 0.69282200 1.0 B B28 1 0.00000000 0.70323900 0.32309700 1.0 B B29 1 0.00000000 0.41887200 0.00000000 1.0 B B30 1 0.50000000 0.86456900 0.59913800 1.0 B B31 1 0.50000000 0.29676100 0.82309700 1.0 B B32 1 0.00000000 0.35892200 0.19282200 1.0 B B33 1 0.00000000 0.81165100 0.63140800 1.0 B B34 1 0.00000000 0.70323900 0.67690300 1.0 B B35 1 0.50000000 0.64107800 0.30717800 1.0 B B36 1 0.00000000 0.91367400 0.85532300 1.0 B B37 1 0.50000000 0.66318100 0.12529200 1.0 B B38 1 0.50000000 0.08632600 0.64467700 1.0 B B39 1 0.00000000 0.47224600 0.76374300 1.0 B B40 1 0.50000000 0.86456900 0.40086200 1.0 B B41 1 0.50000000 0.46001000 0.50000000 1.0 B B42 1 0.00000000 0.97856800 0.77048500 1.0 B B43 1 0.00000000 0.64072600 0.50000000 1.0 B B44 1 0.50000000 0.83247300 0.00000000 1.0 B B45 1 0.00000000 0.13543100 0.90086200 1.0 B B46 1 0.50000000 0.02143200 0.27048500 1.0 B B47 1 0.50000000 0.66318100 0.87470800 1.0 B B48 1 0.50000000 0.38595900 0.41272600 1.0 B B49 1 0.50000000 0.88906000 0.90587900 1.0 B B50 1 0.50000000 0.02143200 0.72951500 1.0 B B51 1 0.00000000 0.81165100 0.36859200 1.0 B B52 1 0.00000000 0.61404100 0.91272600 1.0 B B53 1 0.00000000 0.11094000 0.59412100 1.0 B B54 1 0.50000000 0.52775400 0.73625700 1.0 B B55 1 0.50000000 0.35927400 0.00000000 1.0 B B56 1 0.50000000 0.58112800 0.50000000 1.0 B B57 1 0.50000000 0.88906000 0.09412100 1.0 Mo Mo58 1 0.00000000 0.96681500 0.35601800 1.0 Mo Mo59 1 0.50000000 0.37197200 0.28704200 1.0 Mo Mo60 1 0.00000000 0.34585900 0.50000000 1.0 Mo Mo61 1 0.50000000 0.70948600 0.41991100 1.0 Mo Mo62 1 0.50000000 0.22509000 0.58773300 1.0 Mo Mo63 1 0.00000000 0.29051400 0.08008900 1.0 Mo Mo64 1 0.00000000 0.84516600 0.50000000 1.0 Mo Mo65 1 0.00000000 0.77491000 0.08773300 1.0 Mo Mo66 1 0.50000000 0.03318500 0.85601800 1.0 Mo Mo67 1 0.50000000 0.15483400 0.00000000 1.0 Mo Mo68 1 0.50000000 0.65414100 0.00000000 1.0 Mo Mo69 1 0.00000000 0.77491000 0.91226700 1.0 Mo Mo70 1 0.00000000 0.62802800 0.78704200 1.0 Mo Mo71 1 0.00000000 0.62802800 0.21295800 1.0 Mo Mo72 1 0.50000000 0.22509000 0.41226700 1.0 Mo Mo73 1 0.00000000 0.29051400 0.91991100 1.0 Mo Mo74 1 0.50000000 0.70948600 0.58008900 1.0 Mo Mo75 1 0.50000000 0.03318500 0.14398200 1.0 Mo Mo76 1 0.50000000 0.37197200 0.71295800 1.0 Mo Mo77 1 0.00000000 0.96681500 0.64398200 1.0