#*********************************************************************************<br>
#<br>
# Crystallographic Information File for Amicite <br>
#<br>
# Reference : <br>
#   Alberti, A. and Vezzalini, G.<br>
#   Acta Crystallogr., B35, 2866-2869, (1979)<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_Amicite<br>
_chemical_name_systematic 'Amicite'<br><br>

_cell_length_a      10.226<br>
_cell_length_b      10.422<br>
_cell_length_c      9.884 <br>
_cell_angle_alpha   90 <br>
_cell_angle_beta    88.315 <br>
_cell_angle_gamma   90<br>
_cell_formula_units_Z   1<br>

<br>_space_group.name_H-M_ref   'I 1 2 1'<br>
_symmetry_space_group_name_H-M   'I 1 2 1'<br>
_symmetry_space_group_name_Hall  'I 2y'<br>
_space_group.IT_number  5 <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>
NA  Na  0.4312  0.2559  0.6716  2.53  0.9<br>
K1  K  0.3071  -0.004  0.9692  2.09  0.94<br>
SI1  Si  0.1523  -0.0133  0.3261  0.46  1<br>
SI2  Si  0.1534  0.2615  0.8263  0.4  1<br>
AL1  Al  0.1546  0.2491  0.1546  0.43  1<br>
AL2  Al  0.1582  0.0027  0.6512  0.44  1<br>
O1  O  0.001  -0.0471  0.3037  1.21  1<br>
O2  O  -0.003  0.2956  0.2047  1.14  1<br>
O3  O  0.2031  0.1401  0.7354  0.96  1<br>
O4  O  0.181  0.0304  0.4785  1.18  1<br>
O5  O  0.1712  0.2264  0.9833  1.13  1<br>
O6  O  0.1989  0.1018  0.2263  1  1<br>
O7  O  0.262  0.361  0.2184  1.09  1<br>
O8  O  0.7558  0.3812  0.2177  0.73  1<br>
H2O1  O2-(H2O)  0.3435  0.2507  0.4539  2.65  0.85<br>
H2O2  O2-(H2O)  0.4779  0.0682  0.2179  2.76  0.85<br>
H2O3  O2-(H2O)  0  0.3191  0.5  2.7  1<br>
H2O4  O2-(H2O)  0.5  0.4729  0.5  2.35  0.53<br>

# End of data for Amicite<br>