# generated using pymatgen data_Na4VMo3H20 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.66867710 _cell_length_b 5.09848663 _cell_length_c 11.55147116 _cell_angle_alpha 90.05372352 _cell_angle_beta 89.40671520 _cell_angle_gamma 91.19242111 _symmetry_Int_Tables_number 1 _chemical_formula_structural Na4VMo3H20 _chemical_formula_sum 'Na4 V1 Mo3 H20' _cell_volume 274.88748379 _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 Na Na0 1 0.75232718 0.75182452 0.83981286 1.0 Na Na1 1 0.30704652 0.74847298 0.16022887 1.0 Na Na2 1 0.76552066 0.25393115 0.34261132 1.0 Na Na3 1 0.31173927 0.24666075 0.65780598 1.0 V V4 1 0.80218152 0.75083244 0.55075560 1.0 Mo Mo5 1 0.26913930 0.24862718 0.95233120 1.0 Mo Mo6 1 0.79095768 0.25125045 0.04823118 1.0 Mo Mo7 1 0.26610304 0.74898099 0.45401061 1.0 H H8 1 0.52525499 0.00116013 0.00071933 1.0 H H9 1 0.03629255 0.52624140 0.99877691 1.0 H H10 1 0.05554040 0.02351278 0.49539363 1.0 H H11 1 0.53073105 0.51647091 0.50154671 1.0 H H12 1 0.30077127 0.03701840 0.83441036 1.0 H H13 1 0.75921614 0.46344024 0.16597011 1.0 H H14 1 0.31034013 0.96363635 0.33668032 1.0 H H15 1 0.76357318 0.54756168 0.66526634 1.0 H H16 1 0.74880942 0.04491577 0.16757472 1.0 H H17 1 0.89486697 0.24796835 0.88951346 1.0 H H18 1 0.77468678 0.95791140 0.66439319 1.0 H H19 1 0.29899110 0.53102192 0.33743136 1.0 H H20 1 0.31102924 0.45475322 0.83295203 1.0 H H21 1 0.16508670 0.25185670 0.11124676 1.0 H H22 1 0.92634414 0.74940071 0.38524990 1.0 H H23 1 0.19196326 0.75080691 0.60718952 1.0 H H24 1 0.02361890 0.97358272 0.00157582 1.0 H H25 1 0.53520435 0.49868456 0.99959809 1.0 H H26 1 0.53979249 0.98350725 0.50105756 1.0 H H27 1 0.04287176 0.47597311 0.49766825 1.0