#*********************************************************************************<br>
#<br>
# Crystallographic Information File for SAPO-56 <br>
#<br>
# Reference : <br>
#   McGuire, N.K., Blackwell, C.S., Bateman, C.A., Wilson, S.T. and Kirchner, R.M.<br>
#   private communication, , , (1994)<br>
#<br>
#<br>
# CIF downloaded from the IZA-SC Database of Zeolite Structures<br>
# Ch. Baerlocher, L.B. McCusker and D.H. Brouwer<br>
# Database of Zeolite Structures: https://www.iza-structure.org/databases/ <br>
#<br>
#**********************************************************************************<br>


data_SAPO-56<br>
_chemical_name_systematic 'SAPO-56'<br><br>

_cell_length_a      13.7617<br>
_cell_length_b      13.7617<br>
_cell_length_c      19.949 <br>
_cell_angle_alpha   90 <br>
_cell_angle_beta    90 <br>
_cell_angle_gamma   120<br>
_cell_formula_units_Z   1<br>

<br>_space_group.name_H-M_ref   'P -3 1 c'<br>
_symmetry_space_group_name_H-M   'P -3 1 c'<br>
_symmetry_space_group_name_Hall  '-P 3 2c'<br>
_space_group.IT_number  163 <br>
<br>
 
 loop_<br>
_atom_site_label<br>
_atom_site_type_symbol<br>
_atom_site_fract_x<br>
_atom_site_fract_y<br>
_atom_site_fract_z<br>
_atom_site_B_iso_or_equiv<br>
_atom_site_occupancy<br>
AL1  Al  0.001  0.225  0.077  1.185  1<br>
AL2  Al  0.338  0.439  0.173  1.185  1<br>
P1  P  0.107  0.441  0.179  1.422  1<br>
P2  P  0.231  0.229  0.079  1.422  1<br>
O1  O  -0.126  0.112  0.104  1.974  1<br>
O2  O  0.105  0.189  0.093  1.974  1<br>
O3  O  0.024  0.348  0.119  1.974  1<br>
O4  O  0.013  0.277  -0.006  1.974  1<br>
O5  O  0.231  0.469  0.159  1.974  1<br>
O6  O  0.095  0.54  0.143  1.974  1<br>
O7  O  0.073  0.4  0.242  1.974  1<br>
O8  O  0.319  0.323  0.125  1.974  1<br>

# End of data for SAPO-56<br>