# CIF generated by HEAS from Alexandria entry agm080945113
data_agm080945113
_cell_length_a     5.45070
_cell_length_b     5.45070
_cell_length_c     5.44780
_cell_angle_alpha  61.35267
_cell_angle_beta   118.64733
_cell_angle_gamma  87.58410
_cell_volume       116.62148
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
  'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
  Ca1 Ca 0.24908 0.24505 0.41399 1.00000
  Ca2 Ca 0.75495 0.75092 0.41399 1.00000
  Mo1 Mo 0.99964 0.00036 0.91023 1.00000
  H1 H 0.16750 0.27877 0.90969 1.00000
  H2 H 0.31959 0.92290 0.91972 1.00000
  H3 H 0.68170 0.31830 0.64012 1.00000
  H4 H 0.27143 0.72857 0.36425 1.00000
  H5 H 0.84558 0.15442 0.47159 1.00000
  H6 H 0.90393 0.09607 0.12635 1.00000
  H7 H 0.07710 0.68041 0.91972 1.00000
  H8 H 0.72123 0.83250 0.90969 1.00000