# generated using pymatgen data_Sr7CrN6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.86202742 _cell_length_b 6.75139491 _cell_length_c 13.67381832 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr7CrN6 _chemical_formula_sum 'Sr28 Cr4 N24' _cell_volume 1095.07090627 _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 Sr Sr0 1 0.03605642 0.73519509 0.97880761 1.0 Sr Sr1 1 0.46394358 0.76480491 0.47880761 1.0 Sr Sr2 1 0.53605642 0.76480491 0.02119239 1.0 Sr Sr3 1 0.96394358 0.73519509 0.52119239 1.0 Sr Sr4 1 0.96394358 0.26480491 0.02119239 1.0 Sr Sr5 1 0.53605642 0.23519509 0.52119239 1.0 Sr Sr6 1 0.46394358 0.23519509 0.97880761 1.0 Sr Sr7 1 0.03605642 0.26480491 0.47880761 1.0 Sr Sr8 1 0.22163480 0.85527460 0.62213247 1.0 Sr Sr9 1 0.27836520 0.64472540 0.12213247 1.0 Sr Sr10 1 0.72163480 0.64472540 0.37786753 1.0 Sr Sr11 1 0.77836520 0.85527460 0.87786753 1.0 Sr Sr12 1 0.77836520 0.14472540 0.37786753 1.0 Sr Sr13 1 0.72163480 0.35527460 0.87786753 1.0 Sr Sr14 1 0.27836520 0.35527460 0.62213247 1.0 Sr Sr15 1 0.22163480 0.14472540 0.12213247 1.0 Sr Sr16 1 0.28978291 0.61473802 0.86929239 1.0 Sr Sr17 1 0.21021709 0.88526198 0.36929239 1.0 Sr Sr18 1 0.78978291 0.88526198 0.13070761 1.0 Sr Sr19 1 0.71021709 0.61473802 0.63070761 1.0 Sr Sr20 1 0.71021709 0.38526198 0.13070761 1.0 Sr Sr21 1 0.78978291 0.11473802 0.63070761 1.0 Sr Sr22 1 0.21021709 0.11473802 0.86929239 1.0 Sr Sr23 1 0.28978291 0.38526198 0.36929239 1.0 Sr Sr24 1 -0.00000000 0.43582959 0.75000000 1.0 Sr Sr25 1 0.50000000 0.06417041 0.25000000 1.0 Sr Sr26 1 -0.00000000 0.56417041 0.25000000 1.0 Sr Sr27 1 0.50000000 0.93582959 0.75000000 1.0 Cr Cr28 1 -0.00000000 0.93076152 0.75000000 1.0 Cr Cr29 1 0.50000000 0.56923848 0.25000000 1.0 Cr Cr30 1 -0.00000000 0.06923848 0.25000000 1.0 Cr Cr31 1 0.50000000 0.43076152 0.75000000 1.0 N N32 1 0.11554041 0.77744589 0.78874765 1.0 N N33 1 0.38445959 0.72255411 0.28874765 1.0 N N34 1 0.61554041 0.72255411 0.21125235 1.0 N N35 1 0.88445959 0.77744589 0.71125235 1.0 N N36 1 0.88445959 0.22255411 0.21125235 1.0 N N37 1 0.61554041 0.27744589 0.71125235 1.0 N N38 1 0.38445959 0.27744589 0.78874765 1.0 N N39 1 0.11554041 0.22255411 0.28874765 1.0 N N40 1 0.16519806 0.58661573 0.49667679 1.0 N N41 1 0.33480194 0.91338427 0.99667679 1.0 N N42 1 0.66519806 0.91338427 0.50332321 1.0 N N43 1 0.83480194 0.58661573 0.00332321 1.0 N N44 1 0.83480194 0.41338427 0.50332321 1.0 N N45 1 0.66519806 0.08661573 0.00332321 1.0 N N46 1 0.33480194 0.08661573 0.49667679 1.0 N N47 1 0.16519806 0.41338427 0.99667679 1.0 N N48 1 0.45673883 0.58195947 0.64756176 1.0 N N49 1 0.04326117 0.91804053 0.14756176 1.0 N N50 1 0.95673883 0.91804053 0.35243824 1.0 N N51 1 0.54326117 0.58195947 0.85243824 1.0 N N52 1 0.54326117 0.41804053 0.35243824 1.0 N N53 1 0.95673883 0.08195947 0.85243824 1.0 N N54 1 0.04326117 0.08195947 0.64756176 1.0 N N55 1 0.45673883 0.41804053 0.14756176 1.0