# generated using pymatgen data_CrTe2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.72645490 _cell_length_b 7.72658346 _cell_length_c 12.39910642 _cell_angle_alpha 89.99964950 _cell_angle_beta 90.00494766 _cell_angle_gamma 119.99864744 _symmetry_Int_Tables_number 1 _chemical_formula_structural CrTe2 _chemical_formula_sum 'Cr8 Te16' _cell_volume 641.05414161 _cell_formula_units_Z 8 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Cr Cr0 1 -0.00008280 0.49997059 0.25005579 1.0 Cr Cr1 1 0.50003652 0.00009809 0.25005710 1.0 Cr Cr2 1 -0.00000578 -0.00000027 0.25003208 1.0 Cr Cr3 1 -0.00000607 -0.00000402 0.74998049 1.0 Cr Cr4 1 0.50007023 0.49992161 0.25004077 1.0 Cr Cr5 1 0.50004812 0.49998208 0.74995351 1.0 Cr Cr6 1 0.50005173 0.00007701 0.74995074 1.0 Cr Cr7 1 0.99993632 0.49998079 0.74995956 1.0 Te Te8 1 0.16664034 0.83332527 0.12609226 1.0 Te Te9 1 0.16665061 0.83334422 0.62610663 1.0 Te Te10 1 0.33334119 0.66666238 0.37389009 1.0 Te Te11 1 0.33335456 0.66668221 0.87381673 1.0 Te Te12 1 0.16667257 0.33334082 0.62609979 1.0 Te Te13 1 0.16667457 0.33334884 0.12609950 1.0 Te Te14 1 0.66667333 0.83333307 0.62609759 1.0 Te Te15 1 0.66664021 0.83331761 0.12606374 1.0 Te Te16 1 0.33333078 0.16665792 0.87389577 1.0 Te Te17 1 0.33336672 0.16667127 0.37403068 1.0 Te Te18 1 0.83332098 0.66662418 0.37403252 1.0 Te Te19 1 0.83334256 0.66667539 0.87389344 1.0 Te Te20 1 0.66661575 0.33330841 0.62595401 1.0 Te Te21 1 0.66666390 0.33331374 0.12598459 1.0 Te Te22 1 0.83331702 0.16669916 0.37402900 1.0 Te Te23 1 0.83334964 0.16667062 0.87388462 1.0