#*********************************************************************************
#
# Crystallographic Information File for MnAPO-11, as-made
#
# Reference :
# Pluth, J.J., Smith, J.V. and Richardson Jr., J.W.
# J. Phys. Chem., 92, 2734-2738, (1988)
#
#
# CIF downloaded from the IZA-SC Database of Zeolite Structures
# Ch. Baerlocher and L.B. McCusker,
# Database of Zeolite Structures: http://www.iza-structure.org/databases/
#
#**********************************************************************************
data_MnAPO-11_as-made
_chemical_name_systematic 'MnAPO-11, as-made'

_cell_length_a 13.472
_cell_length_b 18.712
_cell_length_c 8.4431
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_formula_units_Z 1

_space_group.name_H-M_ref 'I b m 2'
_symmetry_space_group_name_H-M 'I b m 2'
_symmetry_space_group_name_Hall 'I 2 -2b'
_space_group.IT_number 46

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 0.139 0.0331 -0.203 3.553 1.034
AL2 Al 0.9501 0.106 0.294 3.553 1.028
AL3 Al 0.8565 0.25 -0.208 2.921 1.01
P1 P 0.1464 0.0365 0.17 3.324 0.913
P2 P 0.9515 0.10846 -0.334 3.024 0.912
P3 P 0.8621 0.25 0.163 2.661 0.904
O1 O 0.143 0.0364 0 9.396 1
O2 O 0.9515 0.112 0.491 10.185 1
O3 O 0.8542 0.25 0.001 10.422 1
O4 O 0.2455 0.0612 0.228 6.711 1
O5 O 0.069 0.0874 0.234 6.632 1
O51 O 0.0564 0.0974 -0.277 6.79 1
O6 O 0.125 0.9611 0.232 7.106 1
O61 O 0.1158 0.9498 -0.276 7.896 1
O7 O 0.9175 0.1863 0.221 8.764 1
O71 O 0.9169 0.1786 -0.267 8.922 1
O8 O 0.762 0.25 0.227 9.554 1
C1 C 0.25 0.25 0.073 21.318 0.646
C2 C 0.246 0.25 0.346 21.318 0.646
C3 C 0.3449 0.25 0.457 13.738 1.292
C4 C 0.161 0.25 0.448 17.371 1.292
N1 N 0.301 0.206 0.242 17.371 0.323
# End of data for MnAPO-11_as-made