# CIF generated by HEAS from Alexandria entry agm005289271 data_agm005289271 _cell_length_a 8.44459 _cell_length_b 9.05192 _cell_length_c 11.93965 _cell_angle_alpha 85.06831 _cell_angle_beta 83.94785 _cell_angle_gamma 80.26662 _cell_volume 892.34821 _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 P1 P 0.83508 0.62404 0.39356 1.00000 P2 P 0.16492 0.37596 0.60644 1.00000 P3 P 0.31481 0.10306 0.89650 1.00000 P4 P 0.68519 0.89694 0.10350 1.00000 H1 H 0.89988 0.69526 0.21143 1.00000 H2 H 0.10012 0.30474 0.78857 1.00000 H3 H 0.01147 0.63779 0.51620 1.00000 H4 H 0.98853 0.36221 0.48380 1.00000 H5 H 0.35500 0.14432 0.71164 1.00000 H6 H 0.64500 0.85568 0.28836 1.00000 H7 H 0.54166 0.12669 0.97152 1.00000 H8 H 0.45834 0.87331 0.02848 1.00000 H9 H 0.68876 0.54981 0.01126 1.00000 H10 H 0.31124 0.45019 0.98874 1.00000 H11 H 0.82653 0.43682 0.91793 1.00000 H12 H 0.17347 0.56318 0.08207 1.00000 H13 H 0.64993 0.36979 0.98294 1.00000 H14 H 0.35007 0.63021 0.01706 1.00000 H15 H 0.75516 0.35994 0.17357 1.00000 H16 H 0.24484 0.64006 0.82643 1.00000 H17 H 0.92673 0.43458 0.11152 1.00000 H18 H 0.07327 0.56542 0.88848 1.00000 H19 H 0.83550 0.14666 0.05633 1.00000 H20 H 0.16450 0.85334 0.94367 1.00000 H21 H 0.00994 0.21302 0.00764 1.00000 H22 H 0.99006 0.78698 0.99236 1.00000 H23 H 0.05150 0.01723 0.15217 1.00000 H24 H 0.94850 0.98277 0.84783 1.00000 H25 H 0.90325 0.11973 0.24516 1.00000 H26 H 0.09675 0.88027 0.75484 1.00000 H27 H 0.18692 0.14158 0.28361 1.00000 H28 H 0.81308 0.85842 0.71639 1.00000 H29 H 0.22366 0.22199 0.14459 1.00000 H30 H 0.77634 0.77801 0.85541 1.00000 H31 H 0.07930 0.31985 0.24482 1.00000 H32 H 0.92070 0.68015 0.75518 1.00000 H33 H 0.78512 0.97899 0.51997 1.00000 H34 H 0.21488 0.02101 0.48003 1.00000 H35 H 0.59936 0.09394 0.49225 1.00000 H36 H 0.40064 0.90606 0.50775 1.00000 H37 H 0.78566 0.15282 0.43896 1.00000 H38 H 0.21434 0.84718 0.56104 1.00000 H39 H 0.66358 0.11840 0.69159 1.00000 H40 H 0.33642 0.88160 0.30841 1.00000 H41 H 0.84977 0.17817 0.63679 1.00000 H42 H 0.15023 0.82183 0.36321 1.00000 H43 H 0.51945 0.32908 0.59533 1.00000 H44 H 0.48055 0.67092 0.40467 1.00000 H45 H 0.69797 0.38873 0.53715 1.00000 H46 H 0.30203 0.61127 0.46285 1.00000 H47 H 0.57862 0.35833 0.78002 1.00000 H48 H 0.42138 0.64167 0.21998 1.00000 H49 H 0.76672 0.41325 0.72543 1.00000 H50 H 0.23328 0.58675 0.27457 1.00000 H51 H 0.55241 0.63896 0.76739 1.00000 H52 H 0.44759 0.36104 0.23261 1.00000 H53 H 0.62087 0.64174 0.62203 1.00000 H54 H 0.37913 0.35826 0.37797 1.00000 H55 H 0.43160 0.58427 0.66988 1.00000 H56 H 0.56840 0.41573 0.33012 1.00000 C1 C 0.74501 0.43397 0.99588 1.00000 C2 C 0.25499 0.56603 0.00412 1.00000 C3 C 0.83651 0.36674 0.09590 1.00000 C4 C 0.16349 0.63326 0.90410 1.00000 C5 C 0.00002 0.13053 0.17730 1.00000 C6 C 0.99998 0.86947 0.82270 1.00000 C7 C 0.12934 0.20932 0.21385 1.00000 C8 C 0.87066 0.79068 0.78615 1.00000 C9 C 0.72347 0.09575 0.51123 1.00000 C10 C 0.27653 0.90425 0.48877 1.00000 C11 C 0.72594 0.17388 0.61857 1.00000 C12 C 0.27406 0.82612 0.38143 1.00000 C13 C 0.64027 0.41854 0.70920 1.00000 C14 C 0.35973 0.58146 0.29080 1.00000 C15 C 0.55632 0.57987 0.69034 1.00000 C16 C 0.44368 0.42013 0.30966 1.00000 N1 N 0.92116 0.21058 0.07722 1.00000 N2 N 0.07884 0.78942 0.92278 1.00000 N3 N 0.64074 0.33300 0.60723 1.00000 N4 N 0.35926 0.66700 0.39277 1.00000 O1 O 0.66935 0.71648 0.37831 1.00000 O2 O 0.33065 0.28352 0.62169 1.00000 O3 O 0.83371 0.45955 0.43543 1.00000 O4 O 0.16629 0.54045 0.56457 1.00000 O5 O 0.94733 0.62769 0.27783 1.00000 O6 O 0.05267 0.37231 0.72217 1.00000 O7 O 0.91704 0.70451 0.48041 1.00000 O8 O 0.08296 0.29549 0.51959 1.00000 O9 O 0.15517 0.21241 0.89605 1.00000 O10 O 0.84483 0.78759 0.10395 1.00000 O11 O 0.30614 0.95796 0.97089 1.00000 O12 O 0.69386 0.04204 0.02911 1.00000 O13 O 0.37398 0.05702 0.77146 1.00000 O14 O 0.62602 0.94298 0.22854 1.00000 O15 O 0.44385 0.19096 0.93752 1.00000 O16 O 0.55615 0.80904 0.06248 1.00000