#*********************************************************************************<br>
#<br>
# Crystallographic Information File for Faujasite <br>
#<br>
# Reference : <br>
#   Baur, W.H.<br>
#   Am. Mineral., 49, 697-704, (1964)<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_Faujasite<br>
_chemical_name_systematic 'Faujasite'<br><br>

_cell_length_a      24.74<br>
_cell_length_b      24.74<br>
_cell_length_c      24.74 <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   'F d -3 m'<br>
_symmetry_space_group_name_H-M   'F d -3 m'<br>
_symmetry_space_group_name_Hall  '-F 4vw 2vw 3'<br>
_space_group.IT_number  227 <br>
_space_group.IT_coordinate_system_code  '2'<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>
NA1  Na  0.0699  0.0699  0.0699  2.6  0.162<br>
CA1  Ca  0.0699  0.0699  0.0699  2.6  0.078<br>
SI1  Si  0.12544  0.94655  0.03626  1.2  0.7<br>
AL1  Al  0.12544  0.94655  0.03626  1.2  0.3<br>
O1  O  0.1742  0.1742  0.968  2.8  1<br>
O2  O  0.1773  0.1773  0.3232  2.5  1<br>
O3  O  0.2527  0.2527  0.1435  2.5  1<br>
O4  O  0.1053  0.8947  0  2.8  1<br>
H2O1  O2-(H2O)  0.1673  0.1673  0.1673  3.2  0.42<br>
H2O2  O2-(H2O)  0.272  0.272  0.272  3.9  0.42<br>

# End of data for Faujasite<br>