# generated using pymatgen
data_Al2Br7N
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.17412900
_cell_length_b   11.90798600
_cell_length_c   13.08016000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2Br7N
_chemical_formula_sum   'Al8 Br28 N4'
_cell_volume   1584.70566942
_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
  Al  Al0  1  0.62065900  0.41570700  0.88311400  1.0
  Al  Al1  1  0.37934100  0.91570700  0.11688600  1.0
  Al  Al2  1  0.12065900  0.91570700  0.61688600  1.0
  Al  Al3  1  0.87934100  0.41570700  0.38311400  1.0
  Al  Al4  1  0.56645100  0.17418900  0.67849100  1.0
  Al  Al5  1  0.43354900  0.67418900  0.32150900  1.0
  Al  Al6  1  0.06645100  0.67418900  0.82150900  1.0
  Al  Al7  1  0.93354900  0.17418900  0.17849100  1.0
  Br  Br8  1  0.29062000  0.97782400  0.51521900  1.0
  Br  Br9  1  0.70938000  0.47782400  0.48478100  1.0
  Br  Br10  1  0.79062000  0.47782400  0.98478100  1.0
  Br  Br11  1  0.20938000  0.97782400  0.01521900  1.0
  Br  Br12  1  0.02794200  0.30483400  0.46869500  1.0
  Br  Br13  1  0.97205800  0.80483400  0.53130500  1.0
  Br  Br14  1  0.52794200  0.80483400  0.03130500  1.0
  Br  Br15  1  0.47205800  0.30483400  0.96869500  1.0
  Br  Br16  1  0.02074700  0.06185000  0.70166600  1.0
  Br  Br17  1  0.97925300  0.56185000  0.29833400  1.0
  Br  Br18  1  0.52074700  0.56185000  0.79833400  1.0
  Br  Br19  1  0.47925300  0.06185000  0.20166600  1.0
  Br  Br20  1  0.73255700  0.29954400  0.75449500  1.0
  Br  Br21  1  0.26744300  0.79954400  0.24550500  1.0
  Br  Br22  1  0.23255700  0.79954400  0.74550500  1.0
  Br  Br23  1  0.76744300  0.29954400  0.25449500  1.0
  Br  Br24  1  0.54641400  0.02314100  0.78687300  1.0
  Br  Br25  1  0.45358600  0.52314100  0.21312700  1.0
  Br  Br26  1  0.04641400  0.52314100  0.71312700  1.0
  Br  Br27  1  0.95358600  0.02314100  0.28687300  1.0
  Br  Br28  1  0.37648100  0.27690300  0.66009200  1.0
  Br  Br29  1  0.62351900  0.77690300  0.33990800  1.0
  Br  Br30  1  0.87648100  0.77690300  0.83990800  1.0
  Br  Br31  1  0.12351900  0.27690300  0.16009200  1.0
  Br  Br32  1  0.66046800  0.12131600  0.52565700  1.0
  Br  Br33  1  0.33953200  0.62131600  0.47434300  1.0
  Br  Br34  1  0.16046800  0.62131600  0.97434300  1.0
  Br  Br35  1  0.83953200  0.12131600  0.02565700  1.0
  N  N36  1  0.14016300  0.26149200  0.87780000  1.0
  N  N37  1  0.85983700  0.76149200  0.12220000  1.0
  N  N38  1  0.64016300  0.76149200  0.62220000  1.0
  N  N39  1  0.35983700  0.26149200  0.37780000  1.0