#*********************************************************************************<br>
#<br>
# Crystallographic Information File for ASU-7 <br>
#<br>
# Reference : <br>
#   Li, H. and Yaghi, O.M.<br>
#   J. Am. Chem. Soc., 120, 10569-10570, (1998)<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_ASU-7<br>
_chemical_name_systematic 'ASU-7'<br><br>

_cell_length_a      8.7795<br>
_cell_length_b      8.7795<br>
_cell_length_c      14.4696 <br>
_cell_angle_alpha   90 <br>
_cell_angle_beta    90 <br>
_cell_angle_gamma   90<br>
_cell_formula_units_Z   1<br>

<br>_space_group.name_H-M_ref   'P 4/m c c'<br>
_symmetry_space_group_name_H-M   'P 4/m c c'<br>
_symmetry_space_group_name_Hall  '-P 4 2c'<br>
_space_group.IT_number  124 <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>
Ge1  Ge  0  0.5  0.25  0.71  1<br>
Ge2  Ge  0.2565  0.4239  0.1086  0.71  1<br>
O1  O  0.1043  0.3755  0.181  0.95  1<br>
O20  O  0.201  0.3595  0  1.11  0.5<br>
O21  O  0.1764  0.4393  0  0.95  0.5<br>
O30  O  0.3257  0.5936  0.1557  1.18  0.5<br>
O31  O  0.3793  0.2692  0.1194  0.95  0.5<br>
H2O1  O2-(H2O)  0.5  0.5  0  2.53  1<br>
C1  C  0  0  0.1258  6.63  0.5<br>
C2  C  -0.0333  0.0537  0.208  7.42  0.125<br>
N1  N  -0.0333  0.0537  0.208  7.42  0.125<br>

# End of data for ASU-7<br>