# generated using pymatgen data_Cr11Ni40Mo9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.24319100 _cell_length_b 9.18292861 _cell_length_c 12.58445597 _cell_angle_alpha 87.45481584 _cell_angle_beta 80.19384543 _cell_angle_gamma 77.46480642 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr11Ni40Mo9 _chemical_formula_sum 'Cr11 Ni40 Mo9' _cell_volume 693.96815535 _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 Cr Cr0 1 0.08875000 0.54529700 0.15461100 1.0 Cr Cr1 1 0.50392700 0.25377800 0.25104900 1.0 Cr Cr2 1 0.79787400 0.39993200 0.20280200 1.0 Cr Cr3 1 0.11104600 0.05489400 0.64606900 1.0 Cr Cr4 1 0.01019100 0.50564200 0.49562200 1.0 Cr Cr5 1 0.39433900 0.19411200 0.59997600 1.0 Cr Cr6 1 0.29995800 0.64845600 0.44949900 1.0 Cr Cr7 1 0.60226400 0.80155900 0.40009900 1.0 Cr Cr8 1 0.89069200 0.94447200 0.35265400 1.0 Cr Cr9 1 0.29815700 0.15036300 0.95015600 1.0 Cr Cr10 1 0.50314300 0.75262800 0.74686100 1.0 Ni Ni11 1 0.30021300 0.98552800 0.11769100 1.0 Ni Ni12 1 0.50405500 0.08264100 0.41836600 1.0 Ni Ni13 1 0.39989000 0.53035700 0.27090700 1.0 Ni Ni14 1 0.79651900 0.23477600 0.36493600 1.0 Ni Ni15 1 0.70227500 0.68127200 0.22154900 1.0 Ni Ni16 1 0.09471400 0.38667100 0.31714700 1.0 Ni Ni17 1 0.99791900 0.83441800 0.17315200 1.0 Ni Ni18 1 0.39944500 0.03419800 0.76487900 1.0 Ni Ni19 1 0.29704300 0.48333900 0.61229900 1.0 Ni Ni20 1 0.70482700 0.18351000 0.71349100 1.0 Ni Ni21 1 0.59819700 0.63810700 0.56292800 1.0 Ni Ni22 1 0.00495400 0.33229800 0.66412600 1.0 Ni Ni23 1 0.90293700 0.78085300 0.51117500 1.0 Ni Ni24 1 0.20071800 0.93092400 0.46708500 1.0 Ni Ni25 1 0.59340200 0.13472900 0.07231200 1.0 Ni Ni26 1 0.50407600 0.58512500 0.91763700 1.0 Ni Ni27 1 0.89964200 0.28444300 0.02057200 1.0 Ni Ni28 1 0.79930300 0.73315200 0.86589200 1.0 Ni Ni29 1 0.20097200 0.43364400 0.96996300 1.0 Ni Ni30 1 0.10173700 0.88526100 0.81326300 1.0 Ni Ni31 1 0.89257900 0.11807600 0.18584500 1.0 Ni Ni32 1 0.10358300 0.21667300 0.48320400 1.0 Ni Ni33 1 0.00233500 0.66625200 0.33449700 1.0 Ni Ni34 1 0.39526300 0.36628400 0.43187400 1.0 Ni Ni35 1 0.30253200 0.81372900 0.28879200 1.0 Ni Ni36 1 0.69720800 0.51951000 0.38364600 1.0 Ni Ni37 1 0.60129800 0.96563800 0.23827200 1.0 Ni Ni38 1 0.00121800 0.16622500 0.82957800 1.0 Ni Ni39 1 0.89882200 0.61508100 0.67693500 1.0 Ni Ni40 1 0.30302600 0.31348200 0.77957900 1.0 Ni Ni41 1 0.20313600 0.76656900 0.62863900 1.0 Ni Ni42 1 0.60174900 0.46857700 0.73059600 1.0 Ni Ni43 1 0.49840700 0.91838200 0.58106700 1.0 Ni Ni44 1 0.80502000 0.06455200 0.52900600 1.0 Ni Ni45 1 0.19640000 0.26927000 0.13482500 1.0 Ni Ni46 1 0.09534600 0.71448000 0.98475900 1.0 Ni Ni47 1 0.50160500 0.41484000 0.08836800 1.0 Ni Ni48 1 0.40109600 0.86707200 0.92908200 1.0 Ni Ni49 1 0.80125400 0.56317000 0.03825200 1.0 Ni Ni50 1 0.69643500 0.01663400 0.88393700 1.0 Mo Mo51 1 0.00303400 0.00315700 0.00011800 1.0 Mo Mo52 1 0.19885400 0.10106900 0.30204900 1.0 Mo Mo53 1 0.39174400 0.69660300 0.10460700 1.0 Mo Mo54 1 0.69884500 0.84941800 0.05304200 1.0 Mo Mo55 1 0.70146800 0.35182400 0.54636100 1.0 Mo Mo56 1 0.20429200 0.60193700 0.79657500 1.0 Mo Mo57 1 0.59496200 0.29839800 0.90169100 1.0 Mo Mo58 1 0.90288800 0.44828400 0.84973100 1.0 Mo Mo59 1 0.80242200 0.89843800 0.69630800 1.0