#*********************************************************************************
#
# Crystallographic Information File for SAPO-56
#
# Reference :
# McGuire, N.K., Blackwell, C.S., Bateman, C.A., Wilson, S.T. and Kirchner, R.M.
# private communication, , , (1994)
#
#
# 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_SAPO-56
_chemical_name_systematic 'SAPO-56'

_cell_length_a 13.7617
_cell_length_b 13.7617
_cell_length_c 19.949
_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 1 c'
_symmetry_space_group_name_H-M 'P -3 1 c'
_symmetry_space_group_name_Hall '-P 3 2c'
_space_group.IT_number 163

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
AL1 Al 0.001 0.225 0.077 1.185 1
AL2 Al 0.338 0.439 0.173 1.185 1
P1 P 0.107 0.441 0.179 1.422 1
P2 P 0.231 0.229 0.079 1.422 1
O1 O -0.126 0.112 0.104 1.974 1
O2 O 0.105 0.189 0.093 1.974 1
O3 O 0.024 0.348 0.119 1.974 1
O4 O 0.013 0.277 -0.006 1.974 1
O5 O 0.231 0.469 0.159 1.974 1
O6 O 0.095 0.54 0.143 1.974 1
O7 O 0.073 0.4 0.242 1.974 1
O8 O 0.319 0.323 0.125 1.974 1
# End of data for SAPO-56