data_Hg3AsP4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.63
_cell_length_b   6.2
_cell_length_c   15.46
_cell_angle_alpha   90.0
_cell_angle_beta   113.4
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Hg3AsP4
_chemical_formula_sum   'Hg12 As4 P16'
_cell_volume   846.52
_cell_formula_units_Z   4
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
  Hg  Hg4  1  0.19  0.21  0.78  1.0
  Hg  Hg5  1  0.37  0.11  0.31  1.0
  Hg  Hg6  1  0.3  0.99  0.4  1.0
  Hg  Hg7  1  0.12  0.09  0.88  1.0
  Hg  Hg8  1  0.48  0.4  0.3  1.0
  Hg  Hg9  1  0.94  0.3  0.98  1.0
  Hg  Hg10  1  0.01  0.8  0.89  1.0
  Hg  Hg11  1  0.55  0.9  0.21  1.0
  Hg  Hg12  1  0.16  1.0  0.35  1.0
  Hg  Hg13  1  0.4  0.1  0.75  1.0
  Hg  Hg14  1  0.33  0.2  0.84  1.0
  Hg  Hg15  1  0.09  0.1  0.44  1.0
  As  As0  1  0.86  0.23  0.26  1.0
  As  As1  1  0.7  0.13  0.83  1.0
  As  As2  1  0.63  0.97  0.93  1.0
  As  As3  1  0.79  0.07  0.35  1.0
  P  P16  1  0.31  0.47  0.27  1.0
  P  P17  1  0.25  0.57  0.82  1.0
  P  P18  1  0.18  0.73  0.92  1.0
  P  P19  1  0.24  0.63  0.36  1.0
  P  P20  1  0.89  0.1  0.42  1.0
  P  P21  1  0.67  0.2  0.68  1.0
  P  P22  1  0.6  0.1  0.77  1.0
  P  P23  1  0.82  1.0  0.51  1.0
  P  P24  1  0.62  0.47  0.78  1.0
  P  P25  1  0.94  0.56  0.31  1.0
  P  P26  1  0.87  0.73  0.4  1.0
  P  P27  1  0.55  0.63  0.88  1.0
  P  P28  1  0.03  0.02  0.97  1.0
  P  P29  1  0.53  0.92  0.12  1.0
  P  P30  1  0.46  0.18  0.22  1.0
  P  P31  1  0.96  0.28  0.06  1.0

data_Hg3AsP4
_symmetry_space_group_name_H-M   P-1
_cell_length_a   6.2
_cell_length_b   9.63
_cell_length_c   14.61
_cell_angle_alpha   103.8
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   Hg3AsP4
_chemical_formula_sum   'Hg12 As4 P16'
_cell_volume   846.52
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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
  Hg  Hg0  2  0.0  0.0  0.35  1.0
  Hg  Hg1  2  0.01  0.59  0.22  1.0
  Hg  Hg2  2  0.1  0.16  0.75  1.0
  Hg  Hg3  2  0.11  0.25  0.69  1.0
  Hg  Hg4  2  0.2  0.69  0.89  1.0
  Hg  Hg5  2  0.3  0.47  0.21  1.0
  As  As6  2  0.03  0.79  0.74  1.0
  As  As7  2  0.13  0.05  0.17  1.0
  P  P8  2  0.0  0.18  0.32  1.0
  P  P9  2  0.08  0.41  0.12  1.0
  P  P10  2  0.1  0.66  0.58  1.0
  P  P11  2  0.18  0.75  0.97  1.0
  P  P12  2  0.37  0.82  0.69  1.0
  P  P13  2  0.37  0.61  0.18  1.0
  P  P14  2  0.47  0.02  0.22  1.0
  P  P15  2  0.47  0.22  0.73  1.0

Hg Hg Hg Hg Hg Hg Hg Hg Hg Hg Hg Hg As As As As P P P P P P P P P P P P P P P P