# CIF generated by HEAS from Alexandria entry agm005264785 data_agm005264785 _cell_length_a 6.11497 _cell_length_b 6.22978 _cell_length_c 11.81678 _cell_angle_alpha 74.19852 _cell_angle_beta 86.93233 _cell_angle_gamma 88.91542 _cell_volume 432.52264 _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 Ca1 Ca 0.02949 0.01699 0.52975 1.00000 Ca2 Ca 0.97194 0.02328 0.99767 1.00000 H1 H 0.72642 0.60743 0.37784 1.00000 H2 H 0.96508 0.74721 0.35019 1.00000 H3 H 0.06284 0.43723 0.36432 1.00000 H4 H 0.31008 0.41075 0.40722 1.00000 H5 H 0.24159 0.96191 0.30223 1.00000 H6 H 0.33017 0.74825 0.40113 1.00000 H7 H 0.78581 0.16423 0.29209 1.00000 H8 H 0.65182 0.24090 0.39159 1.00000 H9 H 0.03304 0.65279 0.86412 1.00000 H10 H 0.27512 0.68548 0.89589 1.00000 H11 H 0.71008 0.45905 0.90163 1.00000 H12 H 0.85588 0.46903 0.78418 1.00000 H13 H 0.69747 0.99537 0.78809 1.00000 H14 H 0.61074 0.79450 0.89941 1.00000 H15 H 0.43162 0.10497 0.88107 1.00000 H16 H 0.35822 0.33526 0.90201 1.00000 H17 H 0.18693 0.23119 0.73289 1.00000 H18 H 0.29937 0.35587 0.61119 1.00000 H19 H 0.74557 0.58561 0.59336 1.00000 H20 H 0.99227 0.50731 0.62082 1.00000 H21 H 0.63198 0.24490 0.60897 1.00000 H22 H 0.56642 0.98959 0.62972 1.00000 H23 H 0.27753 0.78847 0.71712 1.00000 H24 H 0.40214 0.69097 0.61271 1.00000 H25 H 0.68500 0.33565 0.10859 1.00000 H26 H 0.93295 0.38481 0.11906 1.00000 H27 H 0.04381 0.62645 0.19079 1.00000 H28 H 0.24087 0.57941 0.10058 1.00000 H29 H 0.33726 0.22575 0.12169 1.00000 H30 H 0.41111 0.97804 0.13574 1.00000 H31 H 0.71520 0.77279 0.20109 1.00000 H32 H 0.58477 0.69122 0.10551 1.00000 O1 O 0.51143 0.54108 0.43640 1.00000 O2 O 0.48388 0.54490 0.94232 1.00000 O3 O 0.51968 0.48789 0.56641 1.00000 O4 O 0.46866 0.48240 0.07442 1.00000 O5 O 0.86800 0.64984 0.32095 1.00000 O6 O 0.18131 0.32621 0.38996 1.00000 O7 O 0.20601 0.86128 0.38232 1.00000 O8 O 0.75310 0.12487 0.37865 1.00000 O9 O 0.14458 0.77164 0.85356 1.00000 O10 O 0.85914 0.41248 0.87070 1.00000 O11 O 0.67465 0.95041 0.87579 1.00000 O12 O 0.29964 0.20268 0.87940 1.00000 O13 O 0.15778 0.27389 0.64774 1.00000 O14 O 0.88888 0.63460 0.61891 1.00000 O15 O 0.69313 0.08620 0.63498 1.00000 O16 O 0.34286 0.82888 0.63430 1.00000 O17 O 0.83188 0.25669 0.12977 1.00000 O18 O 0.08360 0.64018 0.10727 1.00000 O19 O 0.27782 0.06964 0.14446 1.00000 O20 O 0.64593 0.82879 0.12378 1.00000