#*********************************************************************************
#
# Crystallographic Information File for ZSM-11, calcined
#
# Reference :
# Fyfe, C.A., Gies, H., Kokotailo, G.T., Pasztor, C., Strobl, H. and Cox, D.E.
# J. Am. Chem. Soc., 111, 2470-2474, (1989)
#
#
# 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-11_calcined
_chemical_name_systematic 'ZSM-11, calcined'

_cell_length_a 20.067
_cell_length_b 20.067
_cell_length_c 13.411
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_formula_units_Z 1

_space_group.name_H-M_ref 'I -4 m 2'
_symmetry_space_group_name_H-M 'I -4 m 2'
_symmetry_space_group_name_Hall 'I -4 -2'
_space_group.IT_number 119

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 0.0777 0.0777 0 0.34 1
SI2 Si 0.1212 0.186 0.1451 1.64 1
SI3 Si 0.0775 0.2219 0.3569 1.29 1
SI4 Si 0.2801 0.1882 0.1403 0.39 1
SI5 Si 0.3053 0.0768 -0.0079 0.28 1
SI6 Si 0.1938 0.1938 0.5 1.1 1
SI7 Si 0.0761 0.3819 0.3589 0.01 1
O1 O 0.0873 0 0.0279 3.3 1
O2 O 0.1067 0.1179 0.0975 2.83 1
O3 O 0.0926 0.1856 0.255 1.71 1
O4 O 0.2018 0.1993 0.1506 1.79 1
O5 O 0.3309 0.1186 0.0889 1.62 1
O6 O 0.3003 0 0.0247 0.77 1
O7 O 0.3095 0.1905 0.25 3.27 1
O8 O 0.1204 0.1931 0.4478 0.24 1
O9 O 0.2511 0.1927 0.4252 1.43 1
O10 O 0.0905 0.301 0.3497 1.16 1
O11 O 0 0.209 0.3875 3.49 1
O12 O 0 0.396 0.3871 0.01 1
O13 O 0.0926 0.2437 0.09 1.59 1
O14 O 0.1295 0.4078 0.4348 0.03 1
O15 O 0.0875 0.4125 0.25 0.01 1
# End of data for ZSM-11_calcined