# generated using pymatgen data_V2(CN2)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.02300106 _cell_length_b 5.52328121 _cell_length_c 28.58390792 _cell_angle_alpha 90.00000223 _cell_angle_beta 161.41942540 _cell_angle_gamma 74.00638286 _symmetry_Int_Tables_number 1 _chemical_formula_structural V2(CN2)3 _chemical_formula_sum 'V4 C6 N12' _cell_volume 253.24963008 _cell_formula_units_Z 2 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 0.97009000 0.01187700 0.15666800 1.0 V V1 1 0.97009000 0.01803400 0.65666800 1.0 V V2 1 0.02988300 0.98820300 0.84333400 1.0 V V3 1 0.02988300 0.98191400 0.34333400 1.0 C C4 1 0.94301500 0.69482300 0.06191300 1.0 C C5 1 0.00010400 0.68414800 0.75005600 1.0 C C6 1 0.05694400 0.63784700 0.43809200 1.0 C C7 1 0.94301500 0.36216200 0.56191300 1.0 C C8 1 0.05694400 0.30521000 0.93809200 1.0 C C9 1 0.00010400 0.31574700 0.25005600 1.0 N N10 1 0.85555300 0.77181900 0.07518200 1.0 N N11 1 0.16700700 0.60580600 0.84749900 1.0 N N12 1 0.99599300 0.62802300 0.46001000 1.0 N N13 1 0.85555300 0.37263000 0.57518200 1.0 N N14 1 0.99599300 0.37598400 0.96001000 1.0 N N15 1 0.16700700 0.22718600 0.34749900 1.0 N N16 1 0.14453200 0.22821900 0.92486900 1.0 N N17 1 0.83303200 0.39423400 0.15251600 1.0 N N18 1 0.00384600 0.37210900 0.53996100 1.0 N N19 1 0.14453200 0.62724900 0.42486900 1.0 N N20 1 0.00384600 0.62404400 0.03996100 1.0 N N21 1 0.83303200 0.77273400 0.65251600 1.0