# generated using pymatgen
data_NiH8(NO5)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.96469954
_cell_length_b   10.68953146
_cell_length_c   6.54906541
_cell_angle_alpha   109.13230402
_cell_angle_beta   109.34186306
_cell_angle_gamma   64.85791208
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NiH8(NO5)2
_chemical_formula_sum   'Ni2 H16 N4 O20'
_cell_volume   464.70683622
_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
  Ni  Ni0  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni1  1  0.50000000  0.50000000  0.50000000  1.0
  H  H2  1  0.21530100  0.95503800  0.54222000  1.0
  H  H3  1  0.78469900  0.04496200  0.45778000  1.0
  H  H4  1  0.47632800  0.89064000  0.23518700  1.0
  H  H5  1  0.52367200  0.10936000  0.76481300  1.0
  H  H6  1  0.99875500  0.77405300  0.71492600  1.0
  H  H7  1  0.00124500  0.22594700  0.28507400  1.0
  H  H8  1  0.93343900  0.79262500  0.92720900  1.0
  H  H9  1  0.06656100  0.20737500  0.07279100  1.0
  H  H10  1  0.37332400  0.66610500  0.28432000  1.0
  H  H11  1  0.62667600  0.33389500  0.71568000  1.0
  H  H12  1  0.65056900  0.64854000  0.73496800  1.0
  H  H13  1  0.34943100  0.35146000  0.26503200  1.0
  H  H14  1  0.10406600  0.55330000  0.25699000  1.0
  H  H15  1  0.89593400  0.44670000  0.74301000  1.0
  H  H16  1  0.24575600  0.03031100  0.30475800  1.0
  H  H17  1  0.75424400  0.96968900  0.69524200  1.0
  N  N18  1  0.67240600  0.93630100  0.18505200  1.0
  N  N19  1  0.32759400  0.06369900  0.81494800  1.0
  N  N20  1  0.84894600  0.59997500  0.30751700  1.0
  N  N21  1  0.15105400  0.40002500  0.69248300  1.0
  O  O22  1  0.21825000  0.94517500  0.21491600  1.0
  O  O23  1  0.78175000  0.05482500  0.78508400  1.0
  O  O24  1  0.02912300  0.80534800  0.87831600  1.0
  O  O25  1  0.97087700  0.19465200  0.12168400  1.0
  O  O26  1  0.82638500  0.97695600  0.32134200  1.0
  O  O27  1  0.17361500  0.02304400  0.67865800  1.0
  O  O28  1  0.60721300  0.89256700  0.31788600  1.0
  O  O29  1  0.39278700  0.10743300  0.68211400  1.0
  O  O30  1  0.69238000  0.86220100  0.99760000  1.0
  O  O31  1  0.30762000  0.13779900  0.00240000  1.0
  O  O32  1  0.31631100  0.45242200  0.27475000  1.0
  O  O33  1  0.68368900  0.54757800  0.72525000  1.0
  O  O34  1  0.40491000  0.67467800  0.44506200  1.0
  O  O35  1  0.59509000  0.32532200  0.55493800  1.0
  O  O36  1  0.72014100  0.55714900  0.19973000  1.0
  O  O37  1  0.27985900  0.44285200  0.80027000  1.0
  O  O38  1  0.95986100  0.60477200  0.18970600  1.0
  O  O39  1  0.04013900  0.39522800  0.81029400  1.0
  O  O40  1  0.88580200  0.64421200  0.51263100  1.0
  O  O41  1  0.11419800  0.35578800  0.48736900  1.0