#*********************************************************************************
#
# Crystallographic Information File for AlPO-12-TAMU, as-made 
#
# Reference : 
#   Rudolf, P.R., Saldarriaga-Molina, C. and Clearfield, A.
#   J. Phys. Chem., 90, 6122-6125, (1986)
#
#
# 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_AlPO-12-TAMU_as-made
_chemical_name_systematic 'AlPO-12-TAMU, as-made'

_cell_length_a      10.3325
_cell_length_b      14.6405
_cell_length_c      9.5112 
_cell_angle_alpha   90 
_cell_angle_beta    90 
_cell_angle_gamma   90
_cell_formula_units_Z   1

_space_group.name_H-M_ref   'P 21 21 2'
_symmetry_space_group_name_H-M   'P 21 21 2'
_symmetry_space_group_name_Hall  'P 2 2ab'
_space_group.IT_number  18 

 
 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  0.354  0.608  0.387  3  1
AL2  Al  0.366  0.896  0.383  3  1
AL3  Al  0.349  0.249  0.139  3  1
P1  P  0.339  0.77  0.157  4.8  1
P2  P  0.354  0.112  0.368  4.8  1
P3  P  0.343  0.415  0.369  4.8  1
O1  O  0.338  0.696  0.272  4.3  1
O2  O  0.311  0.864  0.218  4.3  1
O3  O  0.482  0.758  0.086  4.3  1
O4  O  0.249  0.764  0.018  4.3  1
O5  O  0.318  0.137  0.21  4.3  1
O6  O  0.37  0.012  0.381  4.3  1
O7  O  0.485  0.168  0.412  4.3  1
O8  O  0.244  0.143  0.466  4.3  1
O9  O  0.3  0.506  0.317  4.3  1
O10  O  0.337  0.349  0.242  4.3  1
O11  O  0.482  0.412  0.425  4.3  1
O12  O  0.254  0.381  0.488  4.3  1
C1  C  -0.024  0.089  0.196  13.1  1
C2  C  -0.131  -0.017  0.004  13.1  1
C3  C  -0.018  0.587  0.249  13.1  1
C4  C  -0.129  0.482  0.065  13.1  1
N1  N  0  0  0.1  13.1  1
N2  N  0  0.5  0.158  13.1  1
O13  O  0  0  0.284  13.1  1
O14  O  0  0.5  -0.024  13.1  1

# End of data for AlPO-12-TAMU_as-made