# generated using pymatgen
data_MgB2H4C8(N4O)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.00078387
_cell_length_b   10.00078387
_cell_length_c   10.00078387
_cell_angle_alpha   102.79410603
_cell_angle_beta   102.79410603
_cell_angle_gamma   123.85573037
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgB2H4C8(N4O)2
_chemical_formula_sum   'Mg2 B4 H8 C16 N16 O4'
_cell_volume   732.91853293
_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
  Mg  Mg0  1  0.50000000  0.50000000  0.00000000  1.0
  Mg  Mg1  1  0.75000000  0.25000000  0.50000000  1.0
  B  B2  1  0.12500000  0.65925900  0.03425900  1.0
  B  B3  1  0.62500000  0.09074100  0.96574100  1.0
  B  B4  1  0.34074100  0.37500000  0.46574100  1.0
  B  B5  1  0.90925900  0.87500000  0.53425900  1.0
  H  H6  1  0.27206200  0.18406800  0.01826600  1.0
  H  H7  1  0.08419800  0.56593200  0.58799400  1.0
  H  H8  1  0.16580200  0.25379600  0.98173400  1.0
  H  H9  1  0.97793800  0.49620400  0.41200600  1.0
  H  H10  1  0.81593200  0.83419800  0.08799400  1.0
  H  H11  1  0.50379600  0.91580200  0.48173400  1.0
  H  H12  1  0.74620400  0.72793800  0.91200600  1.0
  H  H13  1  0.43406800  0.02206200  0.51826600  1.0
  C  C14  1  0.27648300  0.64344600  0.04524900  1.0
  C  C15  1  0.65180300  0.10655400  0.13303700  1.0
  C  C16  1  0.59819700  0.23123400  0.95475100  1.0
  C  C17  1  0.97351700  0.51876600  0.86696300  1.0
  C  C18  1  0.35655400  0.40180300  0.63303700  1.0
  C  C19  1  0.48123400  0.34819700  0.45475100  1.0
  C  C20  1  0.76876600  0.72351700  0.36696300  1.0
  C  C21  1  0.89344600  0.02648300  0.54524900  1.0
  C  C22  1  0.19313300  0.85128400  0.05224500  1.0
  C  C23  1  0.45096200  0.89871600  0.84184900  1.0
  C  C24  1  0.79903800  0.14088800  0.94775500  1.0
  C  C25  1  0.05686700  0.60911200  0.15815100  1.0
  C  C26  1  0.14871600  0.20096200  0.34184900  1.0
  C  C27  1  0.39088800  0.54903800  0.44775500  1.0
  C  C28  1  0.85911200  0.80686700  0.65815100  1.0
  C  C29  1  0.10128400  0.94313300  0.55224500  1.0
  N  N30  1  0.37698700  0.61905600  0.04406600  1.0
  N  N31  1  0.67501000  0.13094400  0.25793100  1.0
  N  N32  1  0.57499000  0.33292200  0.95593400  1.0
  N  N33  1  0.87301300  0.41707800  0.74206900  1.0
  N  N34  1  0.38094400  0.42501000  0.75793100  1.0
  N  N35  1  0.58292200  0.32499000  0.45593400  1.0
  N  N36  1  0.66707800  0.62301300  0.24206900  1.0
  N  N37  1  0.86905600  0.12698700  0.54406600  1.0
  N  N38  1  0.24011300  0.98939100  0.05900100  1.0
  N  N39  1  0.31961000  0.76060900  0.75072200  1.0
  N  N40  1  0.93039000  0.18111200  0.94099900  1.0
  N  N41  1  0.00988700  0.56888800  0.24927800  1.0
  N  N42  1  0.01060900  0.06961000  0.25072200  1.0
  N  N43  1  0.43111200  0.68039000  0.44099900  1.0
  N  N44  1  0.81888800  0.75988700  0.74927800  1.0
  N  N45  1  0.23939100  0.99011300  0.55900100  1.0
  O  O46  1  0.28124800  0.28124800  0.00000000  1.0
  O  O47  1  0.96875200  0.46875200  0.50000000  1.0
  O  O48  1  0.71875200  0.71875200  0.00000000  1.0
  O  O49  1  0.53124800  0.03124800  0.50000000  1.0