#*********************************************************************************
#
# Crystallographic Information File for STA-2
#
# Reference :
# Noble, G.W., Wright, P.A. and Kvick, Å.
# J. Chem. Soc., Dalton Trans., , 4485-4490, (1997)
#
#
# 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-2
_chemical_name_systematic 'STA-2'
_cell_length_a 12.726
_cell_length_b 12.726
_cell_length_c 30.939
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_formula_units_Z 1
_space_group.name_H-M_ref 'R -3'
_symmetry_space_group_name_H-M 'R -3'
_symmetry_space_group_name_Hall '-R 3'
_space_group.IT_number 148
_space_group.IT_coordinate_system_code 'H'
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
Al1 Al 0.7533 0.7572 0.2954 1.3 1
Al2 Al 0.5762 0.9023 0.2165 1.71 1
P1 P 0.5778 0.9043 0.1144 1.53 1
P2 P 0.7568 1.0013 0.2914 1.08 1
O1 O 0.6138 0.9393 0.1617 2.75 1
O2 O 0.5341 0.7532 0.2251 2.76 1
O3 O 0.7928 0.9072 0.2939 3.05 1
O4 O 0.4612 0.928 0.231 2.81 1
O5 O 0.7014 0.9959 0.2472 2.66 1
O6 O 0.8644 1.1224 0.2968 2.75 1
O7 O 0.6689 0.9831 0.3267 3.64 1
O8 O 0.6563 0.0092 0.0856 2.7 1
N1 N 0 0 0.1025 5.43 1
C1 C 0 0 0.1842 7.76 1
C2 C -0.0415 0.0827 0.1662 10.66 1
C3 C -0.0415 0.0787 0.1177 11.13 1
C4 C -0.0312 0.0351 0.0556 17.02 1
C5 C 0 0 0.0241 14.9 1
H1 H 0 0 0.2147 0 1
H2 H 0.0103 0.1631 0.1757 0 1
H3 H -0.1222 0.0567 0.1762 0 1
H4 H 0.009 0.158 0.1069 0 1
H5 H -0.1226 0.0498 0.0498 0 1
H6 H 0.0075 0.1208 0.054 0 1
H7 H -0.1164 0.0017 0.054 0 1
H8 H 0.0851 0.0322 0.0249 0 1
H9 H -0.0211 0.0263 -0.0015 0 1
# End of data for STA-2