#*********************************************************************************
#
# Crystallographic Information File for Cloverite 
#
# Reference : 
#   Estermann, M., McCusker, L.B., Baerlocher, Ch., Merrouche, A. and Kessler, H.
#   Nature, 352, 320-323, (1991)
#
#
# CIF downloaded from the IZA-SC Database of Zeolite Structures
# Ch. Baerlocher and L.B. McCusker,
# Database of Zeolite Structures: http://www.iza-structure.org/databases/ 
#
#**********************************************************************************


data_Cloverite
_chemical_name_systematic 'Cloverite'

_cell_length_a      51.712
_cell_length_b      51.712
_cell_length_c      51.712 
_cell_angle_alpha   90 
_cell_angle_beta    90 
_cell_angle_gamma   90
_cell_formula_units_Z   1

_space_group.name_H-M_ref   'F m -3 c'
_symmetry_space_group_name_H-M   'F m -3 c'
_symmetry_space_group_name_Hall  '-F 4c 2 3'
_space_group.IT_number  226 

 
 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
Ga1  Ga  0.1341  0.3275  0.278  1.098  1
Ga2  Ga  0.037  0.3507  0.3134  1.382  1
Ga3  Ga  0.0958  0.3654  0.2236  1.105  1
Ga4  Ga  0  0.3242  0.214  1.184  1
Ga5  Ga  0  0.3415  0.3801  2.487  1
P1  P  0.0888  0.3656  0.2818  1.358  1
P2  P  0  0.3226  0.2769  0.742  1
P3  P  0  0.3876  0.3414  1.153  1
P4  P  0.1336  0.321  0.218  0.616  1
P5  P  0.0446  0.3097  0.3556  0.955  1
O1  O  0.08  0.3669  0.2542  2.771  1
O2  O  0.1059  0.3885  0.2891  1.413  1
O3  O  0.1036  0.3404  0.2866  2.448  1
O4  O  0.0657  0.3679  0.2999  1.587  1
O5  O  0.136  0.3124  0.2458  3.995  1
O6  O  0.1339  0.297  0.2951  1.437  1
O7  O  0.1631  0.3439  0.2914  4.572  1
O8  O  0.0237  0.3376  0.283  3.427  1
O9  O  0  0.3158  0.2475  1.2  1
O10  O  0  0.2979  0.2916  2.045  1
O11  O  0.0521  0.3286  0.336  4.24  1
O12  O  0.0242  0.3795  0.3277  3.948  1
O13  O  0  0.3738  0.367  3.119  1
O14  O  0.1091  0.3344  0.2142  3.206  1
O15  O  0.0675  0.3692  0.201  2.258  1
O16  O  -0.0289  0.3436  0.2115  2.795  1
O17  O  0.0283  0.3231  0.3764  3.119  1
O18  O  0  0.4161  0.3461  1.169  1
O19  O  0  0.3461  0.415  5.993  1
F1  F  0.1335  0.3664  0.25  1.729  1
F2  F  0  0.3325  0.3297  2.037  1

# End of data for Cloverite