# generated using pymatgen data_Tm3Mn(Ni4As3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.84508671 _cell_length_b 10.85144357 _cell_length_c 12.66623348 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Tm3Mn(Ni4As3)2 _chemical_formula_sum 'Tm6 Mn2 Ni16 As12' _cell_volume 528.49531648 _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 Tm Tm0 1 0.00000000 0.50000000 0.52453369 1.0 Tm Tm1 1 0.50000000 0.00000000 0.47546631 1.0 Tm Tm2 1 0.50000000 0.82100716 0.20824886 1.0 Tm Tm3 1 0.50000000 0.17899284 0.20824886 1.0 Tm Tm4 1 0.00000000 0.67899284 0.79175114 1.0 Tm Tm5 1 0.00000000 0.32100716 0.79175114 1.0 Mn Mn6 1 0.50000000 0.50000000 0.15385360 1.0 Mn Mn7 1 0.00000000 0.00000000 0.84614640 1.0 Ni Ni8 1 0.50000000 0.50000000 0.69945308 1.0 Ni Ni9 1 0.00000000 0.00000000 0.30054692 1.0 Ni Ni10 1 0.00000000 0.50000000 0.98492694 1.0 Ni Ni11 1 0.50000000 0.00000000 0.01507306 1.0 Ni Ni12 1 0.50000000 0.33394778 0.99557519 1.0 Ni Ni13 1 0.50000000 0.66605222 0.99557519 1.0 Ni Ni14 1 0.00000000 0.16605222 0.00442481 1.0 Ni Ni15 1 0.00000000 0.83394778 0.00442481 1.0 Ni Ni16 1 0.50000000 0.30330008 0.42770634 1.0 Ni Ni17 1 0.50000000 0.69669992 0.42770634 1.0 Ni Ni18 1 0.00000000 0.19669992 0.57229366 1.0 Ni Ni19 1 0.00000000 0.80330008 0.57229366 1.0 Ni Ni20 1 0.50000000 0.87873214 0.70769447 1.0 Ni Ni21 1 0.50000000 0.12126786 0.70769447 1.0 Ni Ni22 1 0.00000000 0.62126786 0.29230553 1.0 Ni Ni23 1 0.00000000 0.37873214 0.29230553 1.0 As As24 1 0.50000000 0.50000000 0.87659903 1.0 As As25 1 0.00000000 0.00000000 0.12340097 1.0 As As26 1 0.50000000 0.50000000 0.35192313 1.0 As As27 1 0.00000000 0.00000000 0.64807687 1.0 As As28 1 0.50000000 0.31467180 0.61378420 1.0 As As29 1 0.50000000 0.68532820 0.61378420 1.0 As As30 1 0.00000000 0.18532820 0.38621580 1.0 As As31 1 0.00000000 0.81467180 0.38621580 1.0 As As32 1 0.50000000 0.84122146 0.88976270 1.0 As As33 1 0.50000000 0.15877854 0.88976270 1.0 As As34 1 0.00000000 0.65877854 0.11023730 1.0 As As35 1 0.00000000 0.34122146 0.11023730 1.0