# CIF generated by HEAS from Alexandria entry agm005226261
data_agm005226261
_cell_length_a     6.31703
_cell_length_b     6.31703
_cell_length_c     21.03967
_cell_angle_alpha  90.00000
_cell_angle_beta   90.00000
_cell_angle_gamma  108.76467
_cell_volume       794.95859
_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 0.96838 0.96838 0.25416 1.00000
  Ca2 Ca 0.03162 0.03162 0.74584 1.00000
  Ca3 Ca 0.53162 0.53162 0.75416 1.00000
  Ca4 Ca 0.46838 0.46838 0.24584 1.00000
  Ca5 Ca 0.23194 0.72474 0.37758 1.00000
  Ca6 Ca 0.27526 0.76806 0.62242 1.00000
  Ca7 Ca 0.77526 0.26806 0.87758 1.00000
  Ca8 Ca 0.73194 0.22474 0.12242 1.00000
  Ca9 Ca 0.76806 0.27526 0.62242 1.00000
  Ca10 Ca 0.72474 0.23194 0.37758 1.00000
  Ca11 Ca 0.22474 0.73194 0.12242 1.00000
  Ca12 Ca 0.26806 0.77526 0.87758 1.00000
  Ca13 Ca 0.23808 0.23808 0.37914 1.00000
  Ca14 Ca 0.76192 0.76192 0.62086 1.00000
  Ca15 Ca 0.26192 0.26192 0.87914 1.00000
  Ca16 Ca 0.73808 0.73808 0.12086 1.00000
  Ca17 Ca 0.00000 0.00000 0.50000 1.00000
  Ca18 Ca 0.50000 0.50000 0.00000 1.00000
  B1 B 0.72933 0.72933 0.36988 1.00000
  B2 B 0.27067 0.27067 0.63012 1.00000
  B3 B 0.77067 0.77067 0.86988 1.00000
  B4 B 0.22933 0.22933 0.13012 1.00000
  B5 B 0.46535 0.96535 0.25000 1.00000
  B6 B 0.03465 0.53465 0.75000 1.00000
  B7 B 0.53465 0.03465 0.75000 1.00000
  B8 B 0.96535 0.46535 0.25000 1.00000
  B9 B 0.50000 0.00000 0.50000 1.00000
  B10 B 0.00000 0.50000 0.50000 1.00000
  B11 B 0.50000 0.00000 0.00000 1.00000
  B12 B 0.00000 0.50000 0.00000 1.00000
  N1 N 0.03068 0.38773 0.44850 1.00000
  N2 N 0.61227 0.96932 0.55150 1.00000
  N3 N 0.11227 0.46932 0.94850 1.00000
  N4 N 0.53068 0.88773 0.05150 1.00000
  N5 N 0.96932 0.61227 0.55150 1.00000
  N6 N 0.38773 0.03068 0.44850 1.00000
  N7 N 0.88773 0.53068 0.05150 1.00000
  N8 N 0.46932 0.11227 0.94850 1.00000
  N9 N 0.55702 0.87354 0.20453 1.00000
  N10 N 0.12646 0.44298 0.79547 1.00000
  N11 N 0.62646 0.94298 0.70453 1.00000
  N12 N 0.05702 0.37354 0.29547 1.00000
  N13 N 0.44298 0.12646 0.79547 1.00000
  N14 N 0.87354 0.55702 0.20453 1.00000
  N15 N 0.37354 0.05702 0.29547 1.00000
  N16 N 0.94298 0.62646 0.70453 1.00000
  N17 N 0.55111 0.55111 0.35702 1.00000
  N18 N 0.44889 0.44889 0.64298 1.00000
  N19 N 0.94889 0.94889 0.85702 1.00000
  N20 N 0.05111 0.05111 0.14298 1.00000
  N21 N 0.91067 0.91067 0.37860 1.00000
  N22 N 0.08933 0.08933 0.62140 1.00000
  N23 N 0.58933 0.58933 0.87860 1.00000
  N24 N 0.41067 0.41067 0.12140 1.00000