# generated using pymatgen
data_P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   48.27397187
_cell_length_b   22.47901117
_cell_length_c   47.07824882
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   P
_chemical_formula_sum   P104
_cell_volume   51087.0159886
_cell_formula_units_Z   104
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
  P  P1  1  0.968021  0.938672  0.294878  1
  P  P2  1  0.968021  0.188672  0.294878  1
  P  P3  1  0.968021  0.438672  0.294878  1
  P  P4  1  0.968021  0.688672  0.294878  1
  P  P5  1  0.031797  0.938672  0.294878  1
  P  P6  1  0.031797  0.188672  0.294878  1
  P  P7  1  0.031797  0.438672  0.294878  1
  P  P8  1  0.031797  0.688672  0.294878  1
  P  P9  1  0.967929  0.813672  0.327859  1
  P  P10  1  0.967929  0.063672  0.327859  1
  P  P11  1  0.967929  0.313672  0.327859  1
  P  P12  1  0.967929  0.563672  0.327859  1
  P  P13  1  0.031889  0.813672  0.327859  1
  P  P14  1  0.031889  0.063672  0.327859  1
  P  P15  1  0.031889  0.313672  0.327859  1
  P  P16  1  0.031889  0.563672  0.327859  1
  P  P17  1  0.967956  0.688672  0.362572  1
  P  P18  1  0.967956  0.938672  0.362572  1
  P  P19  1  0.967956  0.188672  0.362572  1
  P  P20  1  0.967956  0.438672  0.362572  1
  P  P21  1  0.031862  0.688672  0.362572  1
  P  P22  1  0.031862  0.938672  0.362572  1
  P  P23  1  0.031862  0.188672  0.362572  1
  P  P24  1  0.031862  0.438672  0.362572  1
  P  P25  1  0.967973  0.563672  0.397016  1
  P  P26  1  0.967973  0.813672  0.397016  1
  P  P27  1  0.967973  0.063672  0.397016  1
  P  P28  1  0.967973  0.313672  0.397016  1
  P  P29  1  0.031845  0.563672  0.397016  1
  P  P30  1  0.031845  0.813672  0.397016  1
  P  P31  1  0.031845  0.063672  0.397016  1
  P  P32  1  0.031845  0.313672  0.397016  1
  P  P33  1  0.967974  0.438672  0.431700  1
  P  P34  1  0.967974  0.688672  0.431700  1
  P  P35  1  0.967974  0.938672  0.431700  1
  P  P36  1  0.967974  0.188672  0.431700  1
  P  P37  1  0.031844  0.438672  0.431700  1
  P  P38  1  0.031844  0.688672  0.431700  1
  P  P39  1  0.031844  0.938672  0.431700  1
  P  P40  1  0.031844  0.188672  0.431700  1
  P  P41  1  0.967975  0.313672  0.466236  1
  P  P42  1  0.967975  0.563672  0.466236  1
  P  P43  1  0.967975  0.813672  0.466236  1
  P  P44  1  0.967975  0.063672  0.466236  1
  P  P45  1  0.031843  0.313672  0.466236  1
  P  P46  1  0.031843  0.563672  0.466236  1
  P  P47  1  0.031843  0.813672  0.466236  1
  P  P48  1  0.031843  0.063672  0.466236  1
  P  P49  1  0.967974  0.188672  0.500831  1
  P  P50  1  0.967974  0.438672  0.500831  1
  P  P51  1  0.967974  0.688672  0.500831  1
  P  P52  1  0.967974  0.938672  0.500831  1
  P  P53  1  0.031844  0.188672  0.500831  1
  P  P54  1  0.031844  0.438672  0.500831  1
  P  P55  1  0.031844  0.688672  0.500831  1
  P  P56  1  0.031844  0.938672  0.500831  1
  P  P57  1  0.967975  0.063672  0.535425  1
  P  P58  1  0.967975  0.313672  0.535425  1
  P  P59  1  0.967975  0.563672  0.535425  1
  P  P60  1  0.967975  0.813672  0.535425  1
  P  P61  1  0.031843  0.063672  0.535425  1
  P  P62  1  0.031843  0.313672  0.535425  1
  P  P63  1  0.031843  0.563672  0.535425  1
  P  P64  1  0.031843  0.813672  0.535425  1
  P  P65  1  0.967974  0.938672  0.569962  1
  P  P66  1  0.967974  0.188672  0.569962  1
  P  P67  1  0.967974  0.438672  0.569962  1
  P  P68  1  0.967974  0.688672  0.569962  1
  P  P69  1  0.031844  0.938672  0.569962  1
  P  P70  1  0.031844  0.188672  0.569962  1
  P  P71  1  0.031844  0.438672  0.569962  1
  P  P72  1  0.031844  0.688672  0.569962  1
  P  P73  1  0.967973  0.813672  0.604645  1
  P  P74  1  0.967973  0.063672  0.604645  1
  P  P75  1  0.967973  0.313672  0.604645  1
  P  P76  1  0.967973  0.563672  0.604645  1
  P  P77  1  0.031845  0.813672  0.604645  1
  P  P78  1  0.031845  0.063672  0.604645  1
  P  P79  1  0.031845  0.313672  0.604645  1
  P  P80  1  0.031845  0.563672  0.604645  1
  P  P81  1  0.967956  0.688672  0.639090  1
  P  P82  1  0.967956  0.938672  0.639090  1
  P  P83  1  0.967956  0.188672  0.639090  1
  P  P84  1  0.967956  0.438672  0.639090  1
  P  P85  1  0.031862  0.688672  0.639090  1
  P  P86  1  0.031862  0.938672  0.639090  1
  P  P87  1  0.031862  0.188672  0.639090  1
  P  P88  1  0.031862  0.438672  0.639090  1
  P  P89  1  0.967929  0.563672  0.673803  1
  P  P90  1  0.967929  0.813672  0.673803  1
  P  P91  1  0.967929  0.063672  0.673803  1
  P  P92  1  0.967929  0.313672  0.673803  1
  P  P93  1  0.031889  0.563672  0.673803  1
  P  P94  1  0.031889  0.813672  0.673803  1
  P  P95  1  0.031889  0.063672  0.673803  1
  P  P96  1  0.031889  0.313672  0.673803  1
  P  P97  1  0.968021  0.438672  0.706784  1
  P  P98  1  0.968021  0.688672  0.706784  1
  P  P99  1  0.968021  0.938672  0.706784  1
  P  P100  1  0.968021  0.188672  0.706784  1
  P  P101  1  0.031797  0.438672  0.706784  1
  P  P102  1  0.031797  0.688672  0.706784  1
  P  P103  1  0.031797  0.938672  0.706784  1
  P  P104  1  0.031797  0.188672  0.706784  1
