#********************************************************************************* # # 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