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#*********************************************************************************
#
# Crystallographic Information File for CoAPO-50, as-made
#
# Reference :
#
# , , , ()
#
#
# CIF downloaded from the IZA-SC Database of Zeolite Structures
# Ch. Baerlocher, L.B. McCusker and D.H. Brouwer
# Database of Zeolite Structures: https://www.iza-structure.org/databases/
#
#**********************************************************************************
data_CoAPO-50_as-made
_chemical_name_systematic 'CoAPO-50, as-made'

_cell_length_a 12.7468
_cell_length_b 12.7468
_cell_length_c 9.0153
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_formula_units_Z 1

_space_group.name_H-M_ref 'P -3'
_symmetry_space_group_name_H-M 'P -3'
_symmetry_space_group_name_Hall '-P 3'
_space_group.IT_number 147

loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_B_iso_or_equiv
_atom_site_occupancy
AL2 Al 0.85585 0.32535 0.40999 0.09 1
CO1 Co 0.33333 0.66667 0.18423 0.24 1
P1 P 0.66667 0.33333 0.19314 0.23 1
P2 P 0.32138 0.86415 0.38454 0.23 1
O31 O 0.85934 0.44164 0.5244 0.29 1
O32 O 0.3976 0.20587 0.52481 0.39 1
O11 O 0.54705 0.23176 0.25047 0.45 1
O12 O 0.20298 0.50794 0.24269 0.36 1
O14 O 0.33333 0.66667 -0.02687 0.36 1
O2 O 0.3566 0.99417 0.35229 0.44 1
C1 C 0.40093 0.40351 0.07477 8.9 1
C11 C 0.21931 0.21598 0.20291 10.03 1
C2 C 0.46509 0.00622 0.04137 14.41 1
C21 C 0.34138 0.32934 0.23073 17.57 1
N1 N 0.28549 0.01616 0.90866 20.45 1
# End of data for CoAPO-50_as-made