#*********************************************************************************
#
# Crystallographic Information File for COK-14 
#
# Reference :
#   Verheyen, E., Joos, L., Van Havebergh, K., Breynaert, E., Kasian, N., Gobechiya, E., Houthoofd, K., Martineau, C., Hinterstein, M., Taulelle, F., Van Speybroeck, V., Waroquier, M., Bals, S., Van Tendeloo, G., Kirschhock, C.E.A. and Martens, J.A.
#   Nature Mater., 11, 1059-1064, (2012)
#
# CIF downloaded from the IZA-SC Database of Zeolite Structures
# Ch. Baerlocher, L.B. McCusker, D.H. Brouwer and B. Marler
# Database of Zeolite Structures: https://www.iza-structure.org/databases/
#
#*****************************************************************************************

data_COK-14
_chemical_name_systematic 'COK-14'

_cell_length_a      24.1319
_cell_length_b      13.7918
_cell_length_c      12.2977 
_cell_angle_alpha   90 
_cell_angle_beta    109.6 
_cell_angle_gamma   90
_cell_formula_units_Z   1


_space_group.name_H-M_ref   'C 1 2/m 1'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_symmetry_space_group_name_Hall  '-C 2y'
_space_group.IT_number  12 

 
 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
Si3  Si  0.3016  0.7914  0.2446  0.79  1
Si4  Si  0.3131  0.7914  0.5034  7.34  1
Si5  Si  0.3252  0.7955  0.873  2.13  1
Si6  Si  0.3707  0.6846  0.1016  3.71  1
Si7  Si  0.384  0.7052  0.734  2.05  1
Si8  Si  0.2694  0  0.8014  5.21  1
Si9  Si  0.2208  0.5  0.821  2.21  1
Si10  Si  0.3187  0.5  0.6964  0.39  1
Si11  Si  0.2222  0.5  0.4547  0.32  1
Si12  Si  0.299  0.5  0.0577  2.84  1
Si13  Si  0.00003  0.8868  0.125  6.4  1
O1  O  0.3174  0.9033  0.2284  3.32  1
O2  O  0.3399  0.7215  0.1924  7.11  1
O3  O  0.3216  0.7695  0.3811  2.53  1
O4  O  0.2319  0.7702  0.1901  3  1
O5  O  0.3147  0.9064  0.529  6.95  1
O6  O  0.25  0.75  0.5  4.82  1
O7  O  0.3651  0.7327  0.5984  1.5  1
O8  O  0.3616  0.7687  0.0054  4.58  1
O9  O  0.3052  0.9075  0.8716  5.45  1
O10  O  0.3695  0.7931  0.7999  10.03  1
O11  O  0.3333  0.5933  0.0319  4.18  1
O13  O  0.3577  0.5974  0.7352  3.63  1
O14  O  0.2047  0  0.8134  3.16  1
O15  O  0.2667  0  0.668  6.16  1
O16  O  0.2347  0.5  0.9591  1.66  1
O17  O  0.2756  0.5  0.7732  7.11  1
O18  O  0.285  0.5  0.5584  4.03  1
O19  O  0.0456  0.8136  0.2152  1.03  1
Oa  O  0.9377  0.8535  0.134  0.39  1
Ob  O  0  0.127  0  7.03  1
Oc  O  0.0103  0  0.1618  2.21  1
O36  O  -0.0303  -0.246  0.594  1.97  0.08
O41  O  -0.075  0.5  0.583  1.97  0.163

# End of data for COK-14