# CIF generated by HEAS from Alexandria entry agm005223574 data_agm005223574 _cell_length_a 8.61240 _cell_length_b 6.64310 _cell_length_c 17.52468 _cell_angle_alpha 90.09666 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 1002.63767 _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 H1 H 0.79943 0.98596 0.61632 1.00000 H2 H 0.29943 0.01404 0.38368 1.00000 H3 H 0.19887 0.01496 0.88405 1.00000 H4 H 0.69887 0.98504 0.11595 1.00000 H5 H 0.85760 0.51467 0.99002 1.00000 H6 H 0.35760 0.48533 0.00998 1.00000 H7 H 0.14211 0.48661 0.51082 1.00000 H8 H 0.64211 0.51339 0.48918 1.00000 H9 H 0.69987 0.98420 0.86531 1.00000 H10 H 0.19987 0.01580 0.13469 1.00000 H11 H 0.29882 0.01766 0.63471 1.00000 H12 H 0.79882 0.98234 0.36529 1.00000 H13 H 0.96669 0.51557 0.74002 1.00000 H14 H 0.46669 0.48443 0.25998 1.00000 H15 H 0.46587 0.48379 0.75861 1.00000 H16 H 0.96587 0.51621 0.24139 1.00000 N1 N 0.92259 0.99182 0.86992 1.00000 N2 N 0.42259 0.00818 0.13008 1.00000 N3 N 0.07604 0.01026 0.63008 1.00000 N4 N 0.57604 0.98974 0.36992 1.00000 N5 N 0.57751 0.99057 0.62251 1.00000 N6 N 0.07751 0.00943 0.37749 1.00000 N7 N 0.42082 0.00984 0.87809 1.00000 N8 N 0.92082 0.99016 0.12191 1.00000 N9 N 0.74471 0.50959 0.74583 1.00000 N10 N 0.24471 0.49041 0.25417 1.00000 N11 N 0.24318 0.49250 0.75412 1.00000 N12 N 0.74318 0.50750 0.24588 1.00000 N13 N 0.07988 0.51096 0.99676 1.00000 N14 N 0.57988 0.48904 0.00324 1.00000 N15 N 0.91993 0.48870 0.50281 1.00000 N16 N 0.41993 0.51130 0.49719 1.00000 O1 O 0.04360 0.92762 0.84009 1.00000 O2 O 0.54360 0.07238 0.15991 1.00000 O3 O 0.95503 0.07539 0.65961 1.00000 O4 O 0.45503 0.92461 0.34039 1.00000 O5 O 0.87588 0.57618 0.71027 1.00000 O6 O 0.37588 0.42382 0.28973 1.00000 O7 O 0.12204 0.43099 0.78453 1.00000 O8 O 0.62204 0.56901 0.21547 1.00000 O9 O 0.75647 0.39533 0.80004 1.00000 O10 O 0.25647 0.60467 0.19996 1.00000 O11 O 0.25421 0.60619 0.69969 1.00000 O12 O 0.75421 0.39381 0.30031 1.00000 O13 O 0.45583 0.92320 0.59428 1.00000 O14 O 0.95583 0.07680 0.40572 1.00000 O15 O 0.54250 0.07770 0.90620 1.00000 O16 O 0.04250 0.92230 0.09380 1.00000 O17 O 0.91180 0.10862 0.92353 1.00000 O18 O 0.41180 0.89138 0.07647 1.00000 O19 O 0.08678 0.89170 0.57701 1.00000 O20 O 0.58678 0.10830 0.42299 1.00000 O21 O 0.06815 0.39511 0.05052 1.00000 O22 O 0.56815 0.60489 0.94948 1.00000 O23 O 0.93239 0.60592 0.44955 1.00000 O24 O 0.43239 0.39408 0.55045 1.00000 O25 O 0.58927 0.10633 0.67643 1.00000 O26 O 0.08927 0.89367 0.32357 1.00000 O27 O 0.40916 0.89393 0.82423 1.00000 O28 O 0.90916 0.10607 0.17577 1.00000 O29 O 0.20153 0.57766 0.96840 1.00000 O30 O 0.70153 0.42234 0.03160 1.00000 O31 O 0.79800 0.42008 0.53020 1.00000 O32 O 0.29800 0.57992 0.46980 1.00000 O33 O 0.94865 0.57931 0.96171 1.00000 O34 O 0.44865 0.42069 0.03829 1.00000 O35 O 0.05069 0.42082 0.53849 1.00000 O36 O 0.55069 0.57918 0.46151 1.00000 O37 O 0.62298 0.57624 0.71745 1.00000 O38 O 0.12298 0.42376 0.28255 1.00000 O39 O 0.37519 0.41984 0.78737 1.00000 O40 O 0.87519 0.58016 0.21263 1.00000 O41 O 0.70871 0.92314 0.58711 1.00000 O42 O 0.20871 0.07686 0.41289 1.00000 O43 O 0.28959 0.07710 0.91350 1.00000 O44 O 0.78959 0.92290 0.08650 1.00000 O45 O 0.79038 0.91839 0.83696 1.00000 O46 O 0.29038 0.08161 0.16304 1.00000 O47 O 0.20827 0.08459 0.66270 1.00000 O48 O 0.70827 0.91541 0.33730 1.00000