# generated using pymatgen data_Al45V7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.54211584 _cell_length_b 11.00816190 _cell_length_c 11.01490106 _cell_angle_alpha 105.98556925 _cell_angle_beta 110.00043666 _cell_angle_gamma 89.99056350 _symmetry_Int_Tables_number 1 _chemical_formula_structural Al45V7 _chemical_formula_sum 'Al45 V7' _cell_volume 821.63842234 _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 Al Al0 1 0.38495484 0.98980101 0.13721000 1.0 Al Al1 1 0.61504516 0.01019899 0.86279000 1.0 Al Al2 1 0.24780411 0.01025150 0.86257278 1.0 Al Al3 1 0.14917185 0.37681431 0.90983953 1.0 Al Al4 1 0.70704858 0.49046308 0.41473837 1.0 Al Al5 1 0.36515410 0.35088308 0.36015575 1.0 Al Al6 1 0.23897595 0.62301240 0.08997352 1.0 Al Al7 1 0.77754465 0.79459769 0.92765218 1.0 Al Al8 1 0.14212979 0.14459218 0.67068503 1.0 Al Al9 1 0.51920605 0.13201295 0.41110974 1.0 Al Al10 1 0.52855437 0.14449696 0.67082392 1.0 Al Al11 1 0.47144563 0.85550304 0.32917708 1.0 Al Al12 1 0.62462168 0.63770107 0.24983011 1.0 Al Al13 1 0.62400135 0.37977347 0.62007788 1.0 Al Al14 1 0.89209851 0.13228667 0.41138601 1.0 Al Al15 1 0.87130258 0.88652209 0.74226939 1.0 Al Al16 1 0.12869742 0.11347891 0.25773061 1.0 Al Al17 1 0.47881089 0.24314438 0.95721484 1.0 Al Al18 1 0.77555628 0.00666332 0.55091481 1.0 Al Al19 1 0.00324043 0.62015566 0.37973125 1.0 Al Al20 1 0.85787121 0.85540782 0.32931597 1.0 Al Al21 1 0.63484590 0.64911692 0.63984425 1.0 Al Al22 1 0.38493021 0.77298432 0.76957425 1.0 Al Al23 1 0.99675957 0.37984434 0.62026875 1.0 Al Al24 1 0.08946105 0.84744843 0.17887446 1.0 Al Al25 1 0.22245535 0.20540231 0.07234782 1.0 Al Al26 1 0.37537832 0.36229893 0.75016989 1.0 Al Al27 1 0.52118811 0.75685562 0.04278516 1.0 Al Al28 1 0.08218468 0.44196896 0.16466540 1.0 Al Al29 1 0.61506979 0.22701568 0.23042575 1.0 Al Al30 1 0.50000000 0.50000000 0.00000000 1.0 Al Al31 1 0.85082815 0.62318569 0.09016047 1.0 Al Al32 1 0.22444372 0.99333668 0.44908519 1.0 Al Al33 1 0.37599865 0.62022653 0.37992212 1.0 Al Al34 1 0.75219589 0.98974850 0.13742722 1.0 Al Al35 1 0.99492619 0.35117026 0.36041296 1.0 Al Al36 1 0.15039042 0.79464638 0.92754700 1.0 Al Al37 1 0.76102405 0.37698760 0.91002648 1.0 Al Al38 1 0.91781532 0.55803104 0.83533460 1.0 Al Al39 1 0.91053895 0.15255157 0.82112654 1.0 Al Al40 1 0.10790149 0.86771433 0.58861499 1.0 Al Al41 1 0.29295242 0.50953692 0.58526163 1.0 Al Al42 1 0.84960958 0.20535362 0.07245300 1.0 Al Al43 1 0.00507381 0.64882974 0.63958704 1.0 Al Al44 1 0.48079395 0.86798805 0.58889126 1.0 V V45 1 0.74866155 0.75980585 0.49771561 1.0 V V46 1 0.75477869 0.41858278 0.17135658 1.0 V V47 1 0.24522031 0.58141722 0.82864242 1.0 V V48 1 0.25133845 0.24019415 0.50228439 1.0 V V49 1 0.41631055 0.41854514 0.17124813 1.0 V V50 1 0.00000000 0.00000000 0.00000000 1.0 V V51 1 0.58368945 0.58145486 0.82875187 1.0