#*********************************************************************************
#
# Crystallographic Information File for IM-16
#
# Reference :
# Lorgouilloux, Y., Dodin, M., Paillaud, J.-L., Caullet, P., Michelin, L., Josien, L., Ersen, O., Bats, N.
# J. Solid State Chem., 182, 622-629, (2009)
#
#
# 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_IM-16
_chemical_name_systematic 'IM-16'

_cell_length_a 15.0861
_cell_length_b 17.7719
_cell_length_c 19.9764
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_formula_units_Z 1

_space_group.name_H-M_ref 'C m c m'
_symmetry_space_group_name_H-M 'C m c m'
_symmetry_space_group_name_Hall '-C 2c 2'
_space_group.IT_number 63

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
Ge1 Ge 0.3979 0.38872 0.44864 0.0415 0.625
Si1 Si 0.3979 0.38872 0.44864 0.0415 0.375
Ge2 Ge 0.3964 0.33933 0.60215 0.0415 0.526
Si2 Si 0.3964 0.33933 0.60215 0.0415 0.474
Ge3 Ge 0.1034 0.28321 0.59519 0.0415 0.555
Si3 Si 0.1034 0.28321 0.59519 0.0415 0.445
Si4 Si 0.3975 0.16704 0.5595 0.0415 0.478
Ge4 Ge 0.3975 0.16704 0.5595 0.0415 0.522
Si5 Si 0.2258 0.3901 0.67049 0.0415 0.893
Ge5 Ge 0.2258 0.3901 0.67049 0.0415 0.107
Si6 Si 0.276 0.0289 0.57462 0.0415 0.808
Ge6 Ge 0.276 0.0289 0.57462 0.0415 0.192
O1 O 0.3583 0.3685 0.5266 0.0498 1
O2 O 0.5 0.4205 0.453 0.0498 1
O3 O 0.396 0.2466 0.6039 0.0498 1
O4 O 0.3319 0.3749 0.6602 0.0498 1
O5 O 0.5 0.3727 0.6132 0.0498 1
O6 O 0.1735 0.3141 0.6494 0.0498 1
O7 O 0.372 0.1816 0.4792 0.0498 1
O8 O 0.3956 0.3113 0.4035 0.0498 1
O9 O 0.2065 0.4087 0.75 0.0498 1
O10 O 0 0.3147 0.6149 0.0498 1
O11 O 0.327 0.1075 0.5911 0.0498 1
O12 O 0.5 0.1295 0.5624 0.0498 1
O13 O 0.3333 0.4566 0.4163 0.0498 1
O14 O 0.1908 0.4626 0.626 0.0498 1
O15 O 0.2988 0 0.5 0.0498 1
Ow1 O 0 -0.0082 0.1602 0.125 0.109
Ow2 O 0.2488 0.2285 0.5504 0.125 0.157
# End of data for IM-16