# generated using pymatgen data_V2Cu3H6O11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.22151949 _cell_length_b 6.22151949 _cell_length_c 7.19674848 _cell_angle_alpha 83.98015160 _cell_angle_beta 96.01984840 _cell_angle_gamma 123.29743166 _symmetry_Int_Tables_number 1 _chemical_formula_structural V2Cu3H6O11 _chemical_formula_sum 'V2 Cu3 H6 O11' _cell_volume 231.17586261 _cell_formula_units_Z 1 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 V V0 1 0.50539800 0.49460200 0.74959700 1.0 V V1 1 0.49460200 0.50539800 0.25040300 1.0 Cu Cu2 1 0.00000000 0.00000000 0.00000000 1.0 Cu Cu3 1 0.00000000 0.50000000 0.00000000 1.0 Cu Cu4 1 0.50000000 0.00000000 0.00000000 1.0 H H5 1 0.15043000 0.84957000 0.73948700 1.0 H H6 1 0.84957000 0.15043000 0.26051300 1.0 H H7 1 0.01697300 0.72429700 0.43928500 1.0 H H8 1 0.27570300 0.98302700 0.43928500 1.0 H H9 1 0.98302700 0.27570300 0.56071500 1.0 H H10 1 0.72429700 0.01697300 0.56071500 1.0 O O11 1 0.50000000 0.50000000 0.50000000 1.0 O O12 1 0.15324700 0.84675300 0.88246100 1.0 O O13 1 0.84675300 0.15324700 0.11753900 1.0 O O14 1 0.19354400 0.33449900 0.81060700 1.0 O O15 1 0.66550100 0.80645600 0.81060700 1.0 O O16 1 0.80645600 0.66550100 0.18939300 1.0 O O17 1 0.33449900 0.19354400 0.18939300 1.0 O O18 1 0.33752400 0.66247600 0.14580100 1.0 O O19 1 0.66247600 0.33752400 0.85419900 1.0 O O20 1 0.16995500 0.83004500 0.52141500 1.0 O O21 1 0.83004500 0.16995500 0.47858500 1.0