# CIF generated by HEAS from Alexandria entry agm005249012 data_agm005249012 _cell_length_a 6.62785 _cell_length_b 6.62785 _cell_length_c 15.99824 _cell_angle_alpha 96.29249 _cell_angle_beta 96.29249 _cell_angle_gamma 118.09127 _cell_volume 605.74872 _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 0.65466 0.43846 0.53424 1.00000 H2 H 0.90422 0.12042 0.46576 1.00000 H3 H 0.68846 0.40466 0.03424 1.00000 H4 H 0.37042 0.65422 0.96576 1.00000 H5 H 0.43210 0.17566 0.54892 1.00000 H6 H 0.62674 0.88318 0.45108 1.00000 H7 H 0.42566 0.18210 0.04892 1.00000 H8 H 0.13318 0.37674 0.95108 1.00000 H9 H 0.48224 0.28055 0.68493 1.00000 H10 H 0.59562 0.79730 0.31507 1.00000 H11 H 0.53055 0.23224 0.18493 1.00000 H12 H 0.04730 0.34562 0.81507 1.00000 H13 H 0.65528 0.53626 0.81284 1.00000 H14 H 0.72342 0.84244 0.18716 1.00000 H15 H 0.78626 0.40528 0.31284 1.00000 H16 H 0.09244 0.47342 0.68716 1.00000 H17 H 0.79201 0.83924 0.81505 1.00000 H18 H 0.02419 0.97696 0.18495 1.00000 H19 H 0.08924 0.54201 0.31505 1.00000 H20 H 0.22696 0.77419 0.68495 1.00000 H21 H 0.38704 0.41627 0.54219 1.00000 H22 H 0.87408 0.84485 0.45781 1.00000 H23 H 0.66627 0.13704 0.04219 1.00000 H24 H 0.09485 0.62408 0.95781 1.00000 C1 C 0.67677 0.63840 0.69552 1.00000 C2 C 0.94288 0.98126 0.30448 1.00000 C3 C 0.88840 0.42677 0.19552 1.00000 C4 C 0.23126 0.69288 0.80448 1.00000 S1 S 0.19986 0.69986 0.50000 1.00000 S2 S 0.94986 0.94986 0.00000 1.00000 N1 N 0.51015 0.36072 0.56305 1.00000 N2 N 0.79767 0.94711 0.43695 1.00000 N3 N 0.61072 0.26015 0.06305 1.00000 N4 N 0.19711 0.54767 0.93695 1.00000 N5 N 0.57588 0.41451 0.65350 1.00000 N6 N 0.76101 0.92238 0.34650 1.00000 N7 N 0.66451 0.32588 0.15350 1.00000 N8 N 0.17238 0.51101 0.84650 1.00000 N9 N 0.74660 0.79546 0.64259 1.00000 N10 N 0.15288 0.10402 0.35741 1.00000 N11 N 0.04546 0.49660 0.14259 1.00000 N12 N 0.35402 0.90288 0.85741 1.00000 N13 N 0.70809 0.67336 0.78032 1.00000 N14 N 0.89303 0.92777 0.21968 1.00000 N15 N 0.92336 0.45809 0.28032 1.00000 N16 N 0.17777 0.64303 0.71968 1.00000 N17 N 0.83168 0.01868 0.67471 1.00000 N18 N 0.34397 0.15697 0.32529 1.00000 N19 N 0.26868 0.58168 0.17471 1.00000 N20 N 0.40697 0.09397 0.82529 1.00000 O1 O 0.81706 0.09015 0.74972 1.00000 O2 O 0.34043 0.06735 0.25028 1.00000 O3 O 0.34015 0.56706 0.24972 1.00000 O4 O 0.31735 0.09043 0.75028 1.00000 O5 O 0.18268 0.48555 0.52834 1.00000 O6 O 0.95722 0.65434 0.47166 1.00000 O7 O 0.73555 0.93268 0.02834 1.00000 O8 O 0.90434 0.70722 0.97166 1.00000 O9 O 0.33127 0.75170 0.42769 1.00000 O10 O 0.32401 0.90358 0.57231 1.00000 O11 O 0.00170 0.08127 0.92769 1.00000 O12 O 0.15358 0.07401 0.07231 1.00000 O13 O 0.92377 0.15971 0.62598 1.00000 O14 O 0.53374 0.29779 0.37402 1.00000 O15 O 0.40971 0.67377 0.12598 1.00000 O16 O 0.54779 0.28374 0.87402 1.00000