# CIF generated by HEAS from Alexandria entry agm005248155 data_agm005248155 _cell_length_a 6.40878 _cell_length_b 8.48965 _cell_length_c 19.99911 _cell_angle_alpha 85.85019 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 1085.26441 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy B1 B 0.73660 0.08880 0.69344 1.00000 B2 B 0.23660 0.91120 0.80656 1.00000 B3 B 0.26340 0.91120 0.30656 1.00000 B4 B 0.76340 0.08880 0.19344 1.00000 B5 B 0.81435 0.97071 0.62962 1.00000 B6 B 0.31435 0.02929 0.87038 1.00000 B7 B 0.18565 0.02929 0.37038 1.00000 B8 B 0.68565 0.97071 0.12962 1.00000 B9 B 0.76428 0.08346 0.55434 1.00000 B10 B 0.26428 0.91654 0.94566 1.00000 B11 B 0.23572 0.91654 0.44566 1.00000 B12 B 0.73572 0.08346 0.05434 1.00000 B13 B 0.87773 0.29116 0.55358 1.00000 B14 B 0.37773 0.70884 0.94642 1.00000 B15 B 0.12227 0.70884 0.44642 1.00000 B16 B 0.62227 0.29116 0.05358 1.00000 B17 B 0.85079 0.29866 0.68349 1.00000 B18 B 0.35079 0.70134 0.81651 1.00000 B19 B 0.14921 0.70134 0.31651 1.00000 B20 B 0.64921 0.29866 0.18349 1.00000 B21 B 0.58100 0.07073 0.62155 1.00000 B22 B 0.08100 0.92927 0.87845 1.00000 B23 B 0.41900 0.92927 0.37845 1.00000 B24 B 0.91900 0.07073 0.12155 1.00000 B25 B 0.61333 0.25139 0.56898 1.00000 B26 B 0.11333 0.74861 0.93102 1.00000 B27 B 0.38667 0.74861 0.43102 1.00000 B28 B 0.88667 0.25139 0.06898 1.00000 B29 B 0.72975 0.40318 0.60993 1.00000 B30 B 0.22975 0.59682 0.89007 1.00000 B31 B 0.27025 0.59682 0.39007 1.00000 B32 B 0.77025 0.40318 0.10993 1.00000 B33 B 0.59482 0.25542 0.65993 1.00000 B34 B 0.09482 0.74458 0.84007 1.00000 B35 B 0.40518 0.74458 0.34007 1.00000 B36 B 0.90518 0.25542 0.15993 1.00000 H1 H 0.70885 0.03480 0.74945 1.00000 H2 H 0.20885 0.96520 0.75055 1.00000 H3 H 0.29115 0.96520 0.25055 1.00000 H4 H 0.79115 0.03480 0.24945 1.00000 H5 H 0.86149 0.83491 0.63607 1.00000 H6 H 0.36149 0.16509 0.86393 1.00000 H7 H 0.13851 0.16509 0.36393 1.00000 H8 H 0.63851 0.83491 0.13607 1.00000 H9 H 0.75169 0.02144 0.50296 1.00000 H10 H 0.25169 0.97856 0.99704 1.00000 H11 H 0.24831 0.97856 0.49704 1.00000 H12 H 0.74831 0.02144 0.00296 1.00000 H13 H 0.95944 0.34290 0.50325 1.00000 H14 H 0.45944 0.65710 0.99675 1.00000 H15 H 0.04056 0.65710 0.49675 1.00000 H16 H 0.54056 0.34290 0.00325 1.00000 H17 H 0.09134 0.40823 0.61977 1.00000 H18 H 0.59134 0.59177 0.88023 1.00000 H19 H 0.90866 0.59177 0.38023 1.00000 H20 H 0.40866 0.40823 0.11977 1.00000 H21 H 0.42126 0.99850 0.62137 1.00000 H22 H 0.92126 0.00150 0.87863 1.00000 H23 H 0.57874 0.00150 0.37863 1.00000 H24 H 0.07874 0.99850 0.12137 1.00000 H25 H 0.48070 0.28238 0.52817 1.00000 H26 H 0.98070 0.71762 0.97183 1.00000 H27 H 0.51930 0.71762 0.47183 1.00000 H28 H 0.01930 0.28238 0.02817 1.00000 H29 H 0.69772 0.54130 0.60491 1.00000 H30 H 0.19772 0.45870 0.89509 1.00000 H31 H 0.30228 0.45870 0.39509 1.00000 H32 H 0.80228 0.54130 0.10491 1.00000 H33 H 0.45000 0.29061 0.69348 1.00000 H34 H 0.95000 0.70939 0.80652 1.00000 H35 H 0.55000 0.70939 0.30652 1.00000 H36 H 0.05000 0.29061 0.19348 1.00000 H37 H 0.94352 0.04415 0.58130 1.00000 H38 H 0.44352 0.95585 0.91870 1.00000 H39 H 0.05648 0.95585 0.41870 1.00000 H40 H 0.55648 0.04415 0.08130 1.00000 H41 H 0.92464 0.04689 0.67714 1.00000 H42 H 0.42464 0.95311 0.82286 1.00000 H43 H 0.07536 0.95311 0.32286 1.00000 H44 H 0.57536 0.04689 0.17714 1.00000 N1 N 0.76262 0.38057 0.84826 1.00000 N2 N 0.26262 0.61943 0.65174 1.00000 N3 N 0.23738 0.61943 0.15174 1.00000 N4 N 0.73738 0.38057 0.34826 1.00000 N5 N 0.83567 0.37062 0.79620 1.00000 N6 N 0.33567 0.62938 0.70380 1.00000 N7 N 0.16433 0.62938 0.20380 1.00000 N8 N 0.66433 0.37062 0.29620 1.00000 N9 N 0.93051 0.36775 0.74343 1.00000 N10 N 0.43051 0.63225 0.75657 1.00000 N11 N 0.06949 0.63225 0.25657 1.00000 N12 N 0.56949 0.36775 0.24343 1.00000 N13 N 0.96747 0.33151 0.61969 1.00000 N14 N 0.46747 0.66849 0.88031 1.00000 N15 N 0.03253 0.66849 0.38031 1.00000 N16 N 0.53253 0.33151 0.11969 1.00000