#*********************************************************************************
#
# Crystallographic Information File for ZSM-12, calcined
#
# Reference :
# Fyfe, C.A., Gies, H., Kokotailo, G.T., Marler, B. and Cox, D.E.
# J. Phys. Chem., 94, 3718-3721, (1990)
#
#
# 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_ZSM-12_calcined
_chemical_name_systematic 'ZSM-12, calcined'
_cell_length_a 24.8633
_cell_length_b 5.01238
_cell_length_c 24.3275
_cell_angle_alpha 90
_cell_angle_beta 107.7215
_cell_angle_gamma 90
_cell_formula_units_Z 1
_space_group.name_H-M_ref 'C 1 2/c 1'
_symmetry_space_group_name_H-M 'C 1 2/c 1'
_symmetry_space_group_name_Hall '-C 2yc'
_space_group.IT_number 15
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
SI1 Si 0.4402 0.5319 0.4129 0 1
SI2 Si 0.0678 -0.0708 0.4589 0 1
SI3 Si 0.3754 0.032 0.3609 0 1
SI4 Si 0.1338 0.4218 0.4484 0 1
SI5 Si 0.2836 0.0822 0.4275 0 1
SI6 Si 0.2139 0.5853 0.3832 0 1
SI7 Si 0.2869 0.01 0.2463 0 1
O1 O 0.428 0.5053 0.473 0 1
O2 O 0.5034 0.4725 0.4225 0 1
O3 O 0.4245 0.822 0.3872 0 1
O4 O 0.3301 -0.0045 0.3956 0 1
O5 O 0.0841 -0.3624 0.4513 0 1
O6 O 0.3452 -0.0218 0.2972 0 1
O7 O 0.2504 0.2441 0.2629 0 1
O8 O 0.2602 0.3716 0.4078 0 1
O9 O 0.1554 0.5101 0.3911 0 1
O10 O 0.1853 0.448 0.5026 0 1
O11 O 0.2997 0.0905 0.1886 0 1
O12 O 0.3995 0.337 0.3702 0 1
O13 O 0.1069 0.1372 0.4394 0 1
O14 O 0.2343 0.8828 0.4093 0 1
# End of data for ZSM-12_calcined