# generated using pymatgen data_La5MnRe3O16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.12547908 _cell_length_b 11.45566056 _cell_length_c 16.06610170 _cell_angle_alpha 105.59437285 _cell_angle_beta 89.90215442 _cell_angle_gamma 110.79375328 _symmetry_Int_Tables_number 1 _chemical_formula_structural La5MnRe3O16 _chemical_formula_sum 'La20 Mn4 Re12 O64' _cell_volume 1339.28881610 _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 La La0 1 0.74994700 0.49989300 0.87482400 1.0 La La1 1 0.75001200 0.50006400 0.37504900 1.0 La La2 1 0.25000700 0.50004400 0.62501200 1.0 La La3 1 0.25001400 0.50000600 0.12510700 1.0 La La4 1 0.34342000 0.20084300 0.91486200 1.0 La La5 1 0.34266900 0.20115100 0.41531300 1.0 La La6 1 0.84241800 0.20101000 0.66548900 1.0 La La7 1 0.84284800 0.20095700 0.16542500 1.0 La La8 1 0.15781800 0.79898800 0.83428800 1.0 La La9 1 0.15686600 0.79901600 0.33479600 1.0 La La10 1 0.65704100 0.79890900 0.58489900 1.0 La La11 1 0.65690400 0.79915500 0.08493000 1.0 La La12 1 0.86811400 0.20980800 0.91783400 1.0 La La13 1 0.86867000 0.21014100 0.41803900 1.0 La La14 1 0.36885100 0.20977500 0.66822200 1.0 La La15 1 0.36855200 0.20999600 0.16808400 1.0 La La16 1 0.63101400 0.79004700 0.83168000 1.0 La La17 1 0.63160200 0.79018800 0.33196100 1.0 La La18 1 0.13155500 0.79005400 0.58202900 1.0 La La19 1 0.13170300 0.79005200 0.08216000 1.0 Mn Mn20 1 0.00011000 0.99999900 0.74997700 1.0 Mn Mn21 1 0.49985700 0.99997200 0.50001300 1.0 Mn Mn22 1 0.99986500 0.99999400 0.25004300 1.0 Mn Mn23 1 0.50016500 0.00001900 0.99993600 1.0 Re Re24 1 0.50008800 0.99989500 0.74971800 1.0 Re Re25 1 0.49989700 0.00010900 0.25029800 1.0 Re Re26 1 0.99990700 0.00010700 0.50032000 1.0 Re Re27 1 0.00010500 0.99988400 0.99968000 1.0 Re Re28 1 0.30301200 0.60529100 0.92841500 1.0 Re Re29 1 0.30317100 0.60553700 0.42823000 1.0 Re Re30 1 0.80309600 0.60538300 0.67834100 1.0 Re Re31 1 0.80306800 0.60541700 0.17825900 1.0 Re Re32 1 0.19687300 0.39454300 0.82171400 1.0 Re Re33 1 0.19695100 0.39466100 0.32166000 1.0 Re Re34 1 0.69690600 0.39461600 0.57169300 1.0 Re Re35 1 0.69690900 0.39455700 0.07169600 1.0 O O36 1 0.21936100 0.43422700 0.95471400 1.0 O O37 1 0.21935400 0.43422200 0.45459200 1.0 O O38 1 0.71932300 0.43425400 0.70467300 1.0 O O39 1 0.71936500 0.43411300 0.20463100 1.0 O O40 1 0.28061600 0.56571600 0.79538600 1.0 O O41 1 0.28070400 0.56586200 0.29531300 1.0 O O42 1 0.78064400 0.56571700 0.54535400 1.0 O O43 1 0.78059100 0.56581100 0.04533900 1.0 O O44 1 0.34039600 0.67523100 0.05735500 1.0 O O45 1 0.34049900 0.67535500 0.55728700 1.0 O O46 1 0.84049600 0.67538000 0.80730800 1.0 O O47 1 0.84037500 0.67527700 0.30731900 1.0 O O48 1 0.15955500 0.32468900 0.69276800 1.0 O O49 1 0.15955500 0.32467200 0.19262100 1.0 O O50 1 0.65947000 0.32459500 0.44267700 1.0 O O51 1 0.65966000 0.32480700 0.94267400 1.0 O O52 1 0.39917000 0.79848200 0.92540400 1.0 O O53 1 0.39919800 0.79864800 0.42539500 1.0 O O54 1 0.89911800 0.79841800 0.67535600 1.0 O O55 1 0.89921800 0.79849700 0.17533300 1.0 O O56 1 0.10084300 0.20153300 0.82466300 1.0 O O57 1 0.10082700 0.20156100 0.32461900 1.0 O O58 1 0.60085200 0.20141400 0.57456800 1.0 O O59 1 0.60074300 0.20143800 0.07465000 1.0 O O60 1 0.40961100 0.81679500 0.74251100 1.0 O O61 1 0.40953900 0.81732000 0.24259300 1.0 O O62 1 0.90991300 0.81758100 0.49261800 1.0 O O63 1 0.90990400 0.81769300 0.99262100 1.0 O O64 1 0.09017400 0.18222900 0.00730300 1.0 O O65 1 0.09000300 0.18244600 0.50745800 1.0 O O66 1 0.59053200 0.18320400 0.75742200 1.0 O O67 1 0.59032200 0.18270500 0.25747500 1.0 O O68 1 0.55446300 0.63540100 0.92563700 1.0 O O69 1 0.55501200 0.63538500 0.42588000 1.0 O O70 1 0.05475400 0.63528700 0.67579500 1.0 O O71 1 0.05500200 0.63545400 0.17570600 1.0 O O72 1 0.94528600 0.36479500 0.82424500 1.0 O O73 1 0.94507600 0.36450500 0.32431200 1.0 O O74 1 0.44527500 0.36465100 0.57417100 1.0 O O75 1 0.44513900 0.36453400 0.07426100 1.0 O O76 1 0.08082400 0.63466500 0.92889600 1.0 O O77 1 0.08034100 0.63457700 0.42915000 1.0 O O78 1 0.58052200 0.63446600 0.67904000 1.0 O O79 1 0.58041000 0.63466600 0.17898600 1.0 O O80 1 0.41951800 0.36565400 0.82098700 1.0 O O81 1 0.41945500 0.36522400 0.32108000 1.0 O O82 1 0.91946100 0.36543800 0.57091500 1.0 O O83 1 0.91945100 0.36529900 0.07094700 1.0 O O84 1 0.23960400 0.99646300 0.96813100 1.0 O O85 1 0.23940800 0.99640400 0.46838800 1.0 O O86 1 0.74021100 0.99637600 0.71835000 1.0 O O87 1 0.73988000 0.99657300 0.21799200 1.0 O O88 1 0.25988700 0.00356300 0.78172300 1.0 O O89 1 0.26001400 0.00349900 0.28195400 1.0 O O90 1 0.76049700 0.00369800 0.53152500 1.0 O O91 1 0.76051800 0.00345500 0.03193400 1.0 O O92 1 0.07755700 0.03762400 0.62464300 1.0 O O93 1 0.07687600 0.03799400 0.12436100 1.0 O O94 1 0.57704600 0.03761800 0.37441700 1.0 O O95 1 0.57702900 0.03823900 0.87460300 1.0 O O96 1 0.42330300 0.96189200 0.12563000 1.0 O O97 1 0.42265000 0.96223400 0.62534900 1.0 O O98 1 0.92276600 0.96247200 0.87561200 1.0 O O99 1 0.92283300 0.96192300 0.37539000 1.0