# generated using pymatgen data_Tm4C2Cl3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.57768100 _cell_length_b 10.26838762 _cell_length_c 19.22206657 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm4C2Cl3 _chemical_formula_sum 'Tm16 C8 Cl12' _cell_volume 706.16135276 _cell_formula_units_Z 4 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 Tm Tm0 1 0.25000000 0.86508133 0.57395045 1.0 Tm Tm1 1 0.75000000 0.13491867 0.42604955 1.0 Tm Tm2 1 0.75000000 0.63491867 0.07395045 1.0 Tm Tm3 1 0.25000000 0.36508133 0.92604955 1.0 Tm Tm4 1 0.25000000 0.86965993 0.74346821 1.0 Tm Tm5 1 0.75000000 0.13034007 0.25653179 1.0 Tm Tm6 1 0.75000000 0.63034007 0.24346821 1.0 Tm Tm7 1 0.25000000 0.36965993 0.75653179 1.0 Tm Tm8 1 0.25000000 0.86863830 0.16574825 1.0 Tm Tm9 1 0.75000000 0.13136170 0.83425175 1.0 Tm Tm10 1 0.75000000 0.63136170 0.66574825 1.0 Tm Tm11 1 0.25000000 0.36863830 0.33425175 1.0 Tm Tm12 1 0.25000000 0.89324122 0.33220690 1.0 Tm Tm13 1 0.75000000 0.10675878 0.66779310 1.0 Tm Tm14 1 0.75000000 0.60675878 0.83220690 1.0 Tm Tm15 1 0.25000000 0.39324122 0.16779310 1.0 C C16 1 0.25000000 0.61893202 0.75083579 1.0 C C17 1 0.75000000 0.38106798 0.24916421 1.0 C C18 1 0.75000000 0.88106798 0.25083579 1.0 C C19 1 0.25000000 0.11893202 0.74916421 1.0 C C20 1 0.25000000 0.62981018 0.15207575 1.0 C C21 1 0.75000000 0.37018982 0.84792425 1.0 C C22 1 0.75000000 0.87018982 0.65207575 1.0 C C23 1 0.25000000 0.12981018 0.34792425 1.0 Cl Cl24 1 0.25000000 0.61558102 0.55572295 1.0 Cl Cl25 1 0.75000000 0.38441898 0.44427705 1.0 Cl Cl26 1 0.75000000 0.88441898 0.05572295 1.0 Cl Cl27 1 0.25000000 0.11558102 0.94427705 1.0 Cl Cl28 1 0.25000000 0.62613347 0.95397296 1.0 Cl Cl29 1 0.75000000 0.37386653 0.04602704 1.0 Cl Cl30 1 0.75000000 0.87386653 0.45397296 1.0 Cl Cl31 1 0.25000000 0.12613347 0.54602704 1.0 Cl Cl32 1 0.25000000 0.63257214 0.35456595 1.0 Cl Cl33 1 0.75000000 0.36742786 0.64543405 1.0 Cl Cl34 1 0.75000000 0.86742786 0.85456595 1.0 Cl Cl35 1 0.25000000 0.13257214 0.14543405 1.0