#*********************************************************************************
#
# Crystallographic Information File for UCSB-8Co 
#
# Reference : 
#   Bu, X., Feng, P. and Stucky, G.D.
#   Science, 278, 2080-2085, (1997)
#
#
# 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_UCSB-8Co
_chemical_name_systematic 'UCSB-8Co'

_cell_length_a      19.0654
_cell_length_b      19.0654
_cell_length_c      27.594 
_cell_angle_alpha   90 
_cell_angle_beta    90 
_cell_angle_gamma   90
_cell_formula_units_Z   1

_space_group.name_H-M_ref   'P 4/n n c'
_symmetry_space_group_name_H-M   'P 4/n n c'
_symmetry_space_group_name_Hall  '-P 4a 2bc'
_space_group.IT_number  126 
_space_group.IT_coordinate_system_code  '2'

 
 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  0.4567  0.1672  0.5127  2.3  0.5
Co1  Co  0.4567  0.1672  0.5127  2.3  0.5
Al2  Al  0.3317  0.0477  0.8051  2.4  0.5
Co2  Co  0.3317  0.0477  0.8051  2.4  0.5
Al3  Al  0.3269  -0.0423  0.5995  2.3  0.5
Co3  Co  0.3269  -0.0423  0.5995  2.3  0.5
Al4  Al  0.4015  -0.1712  0.9551  2.4  0.5
Co4  Co  0.4015  -0.1712  0.9551  2.4  0.5
P1  P  0.3358  0.049  0.5055  2.6  1
P2  P  0.3335  0.0501  0.6916  2.1  1
P3  P  0.3381  -0.0486  0.8941  2.4  1
P4  P  0.3991  -0.1636  0.5484  2.4  1
O1  O  0.3443  0.0224  0.7421  3  1
O2  O  0.3817  0.1116  0.4947  4.8  1
O3  O  0.3797  -0.1151  0.9041  4.5  1
O4  O  0.3798  -0.1174  0.5918  3.9  1
O5  O  0.3495  -0.0085  0.6576  4.3  1
O6  O  0.3491  -0.0278  0.8419  3.8  1
O7  O  0.3475  -0.1555  0.0081  3.9  1
O8  O  0.3524  0.0209  0.5559  3.9  1
O9  O  0.3808  0.1121  0.6815  4.9  1
O10  O  0.5292  0.1415  0.4681  4.3  1
O11  O  0.3969  -0.2397  0.5644  4.5  1
O12  O  0.2391  -0.0627  0.5963  4.8  1
O13  O  0.2585  0.0743  0.6842  3.2  1
O14  O  0.4306  0.2596  0.5031  4.3  1
O15  O  0.3519  -0.0073  0.4685  4.3  1
O16  O  0.4888  0.1397  0.574  4.5  1
N1  N  0.4831  0.0187  0.415  6.1  1
C1  C  0.4727  0.0323  0.3615  7.7  1
C2  C  0.408  0.1047  0.3607  2.2  1

# End of data for UCSB-8Co