#*********************************************************************************
#
# Crystallographic Information File for STA-20
#
# Reference :
# Turrina, A., Garcia, R., Watts, A.E., Greer, H.F., Bradley, J., Zhou, W., Cox, P.A., Shannon, M.D., Mayoral, A., Casci, J.L. and Wright, P.A.
# Chem. Mater., 29, 2180-2190, (2017)
#
#
# 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_STA-20
_chemical_name_systematic 'STA-20'
_cell_length_a 13.15497
_cell_length_b 13.15497
_cell_length_c 30.5833
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_formula_units_Z 1
_space_group.name_H-M_ref 'P -3 1 c'
_symmetry_space_group_name_H-M 'P -3 1 c'
_symmetry_space_group_name_Hall '-P 3 2c'
_space_group.IT_number 163
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
P1 P 0.23862 0.23032 0.05157 0.46 0.95
Si1 Si 0.23862 0.23032 0.05157 0.46 0.05
P2 P 0.23733 0.23589 0.20008 0.46 0.95
Si2 Si 0.23733 0.23589 0.20008 0.46 0.05
P3 P 0.66699 0.57353 0.62448 0.46 0.95
Si3 Si 0.66699 0.57353 0.62448 0.46 0.05
Al1 Al 0.3319 0.419 0.12439 0.46 1
Al2 Al 0.2361 1.002 0.19875 0.46 1
Al3 Al 0.2317 0.992 0.05009 0.46 1
O1 O 0.3207 0.3343 0.07975 0.75 1
O2 O 0.3185 0.3409 0.1716 0.75 1
O3 O 0.6769 0.6414 0.5824 0.75 1
O4 O 0.6767 0.6491 0.66494 0.75 1
O5 O 0.2745 0.2646 0.0042 0.75 1
O6 O 0.1139 0.2003 0.0593 0.75 1
O7 O 0.2213 0.4542 0.1231 0.75 1
O8 O 0.1088 0.2002 0.1936 0.75 1
O9 O 0.2504 0.126 0.06392 0.75 1
O10 O 0.2499 0.1348 0.1842 0.75 1
O11 O 0.46628 0.5452 0.12401 0.75 1
O12 O 0.2781 0.2685 0.24729 0.75 1
# End of data for STA-20