# generated using pymatgen data_Cr2(PO4)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.57279900 _cell_length_b 8.43345700 _cell_length_c 14.45091507 _cell_angle_alpha 55.18746590 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Cr2(PO4)3 _chemical_formula_sum 'Cr8 P12 O48' _cell_volume 857.78738870 _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 Cr Cr0 1 0.46666300 0.86587600 0.38077100 1.0 Cr Cr1 1 0.53044900 0.37241500 0.88124200 1.0 Cr Cr2 1 0.53333700 0.13412400 0.61922900 1.0 Cr Cr3 1 0.46955100 0.62758500 0.11875800 1.0 Cr Cr4 1 0.96955100 0.37241500 0.38124200 1.0 Cr Cr5 1 0.03044900 0.62758500 0.61875800 1.0 Cr Cr6 1 0.96666300 0.13412400 0.11922900 1.0 Cr Cr7 1 0.03333700 0.86587600 0.88077100 1.0 P P8 1 0.61231400 0.96627100 0.14373600 1.0 P P9 1 0.11231400 0.03372900 0.35626400 1.0 P P10 1 0.24793600 0.45899900 0.00802200 1.0 P P11 1 0.74793600 0.54100100 0.49197800 1.0 P P12 1 0.61770000 0.24950000 0.35425600 1.0 P P13 1 0.25206400 0.45899900 0.50802200 1.0 P P14 1 0.88768600 0.96627100 0.64373600 1.0 P P15 1 0.38768600 0.03372900 0.85626400 1.0 P P16 1 0.38230000 0.75050000 0.64574400 1.0 P P17 1 0.11770000 0.75050000 0.14574400 1.0 P P18 1 0.75206400 0.54100100 0.99197800 1.0 P P19 1 0.88230000 0.24950000 0.85425600 1.0 O O20 1 0.57645900 0.09986500 0.32884400 1.0 O O21 1 0.12589100 0.47998700 0.42678100 1.0 O O22 1 0.18535700 0.47821200 0.60089700 1.0 O O23 1 0.49139300 0.90884600 0.23735700 1.0 O O24 1 0.33237800 0.26187500 0.56589800 1.0 O O25 1 0.99139300 0.09115400 0.26264300 1.0 O O26 1 0.70639900 0.29056300 0.83100200 1.0 O O27 1 0.51993300 0.43372200 0.27317700 1.0 O O28 1 0.92437400 0.17353900 0.97551200 1.0 O O29 1 0.07562600 0.82646100 0.02448800 1.0 O O30 1 0.57562600 0.17353900 0.47551200 1.0 O O31 1 0.72558300 0.98854100 0.67943100 1.0 O O32 1 0.62589100 0.52001300 0.07321900 1.0 O O33 1 0.37410900 0.47998700 0.92678100 1.0 O O34 1 0.00860700 0.90884600 0.73735700 1.0 O O35 1 0.42437400 0.82646100 0.52448800 1.0 O O36 1 0.88549700 0.80580200 0.62256400 1.0 O O37 1 0.66762200 0.73812500 0.43410200 1.0 O O38 1 0.79360100 0.29056300 0.33100200 1.0 O O39 1 0.83237800 0.73812500 0.93410200 1.0 O O40 1 0.31464300 0.47821200 0.10089700 1.0 O O41 1 0.27441700 0.01145900 0.32056900 1.0 O O42 1 0.01993300 0.56627800 0.22682300 1.0 O O43 1 0.50860700 0.09115400 0.76264300 1.0 O O44 1 0.16762200 0.26187500 0.06589800 1.0 O O45 1 0.62893300 0.37733100 0.56504500 1.0 O O46 1 0.87410900 0.52001300 0.57321900 1.0 O O47 1 0.81464300 0.52178800 0.39910300 1.0 O O48 1 0.93822900 0.16016200 0.53777300 1.0 O O49 1 0.48006700 0.56627800 0.72682300 1.0 O O50 1 0.56177100 0.16016200 0.03777300 1.0 O O51 1 0.92354100 0.09986500 0.82884400 1.0 O O52 1 0.43822900 0.83983800 0.96222700 1.0 O O53 1 0.07645900 0.90013500 0.17115600 1.0 O O54 1 0.87106700 0.37733100 0.06504500 1.0 O O55 1 0.12893300 0.62266900 0.93495500 1.0 O O56 1 0.11450300 0.19419800 0.37743600 1.0 O O57 1 0.29360100 0.70943700 0.16899800 1.0 O O58 1 0.22558300 0.01145900 0.82056900 1.0 O O59 1 0.20639900 0.70943700 0.66899800 1.0 O O60 1 0.68535700 0.52178800 0.89910300 1.0 O O61 1 0.98006700 0.43372200 0.77317700 1.0 O O62 1 0.42354100 0.90013500 0.67115600 1.0 O O63 1 0.61450300 0.80580200 0.12256400 1.0 O O64 1 0.38549700 0.19419800 0.87743600 1.0 O O65 1 0.06177100 0.83983800 0.46222700 1.0 O O66 1 0.77441700 0.98854100 0.17943100 1.0 O O67 1 0.37106700 0.62266900 0.43495500 1.0