# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CA7' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy C0 C -5.83400 0.76900 -0.43200 1.000 O1 O -4.74700 0.52800 0.46500 1.000 C2 C -7.13800 0.87200 0.36300 1.000 O3 O -7.02400 1.91200 1.33600 1.000 C4 C -7.40500 -0.46100 1.06800 1.000 O5 O -8.65700 -0.39800 1.75200 1.000 C6 C -7.44800 -1.57900 0.02200 1.000 O7 O -7.62500 -2.83800 0.67500 1.000 C8 C -6.13100 -1.58800 -0.76000 1.000 O9 O -5.93000 -0.30900 -1.36500 1.000 C10 C -6.19000 -2.66300 -1.84700 1.000 O11 O -4.92200 -2.75100 -2.49900 1.000 O12 O -1.89900 -2.40100 1.33200 1.000 O13 O -1.21300 3.67400 -0.52100 1.000 O14 O -3.95900 2.94500 -0.84700 1.000 C15 C 5.41000 0.35500 -0.26100 1.000 C16 C 4.05200 0.18900 0.42600 1.000 C17 C 6.47600 -0.41200 0.52500 1.000 C18 C 13.08200 -0.07700 0.02900 1.000 C19 C 2.98600 0.95500 -0.36000 1.000 C20 C 7.83300 -0.24500 -0.16100 1.000 C21 C 12.65500 -1.54500 -0.03600 1.000 C22 C 12.04100 0.78900 -0.68300 1.000 C23 C 1.62900 0.78900 0.32600 1.000 C24 C -2.80100 -1.62800 0.53700 1.000 C25 C 8.89900 -1.01200 0.62400 1.000 C26 C 11.29700 -1.71100 0.65000 1.000 C27 C 10.68400 0.62300 0.00300 1.000 O28 O -1.13400 0.06100 0.08200 1.000 O29 O 0.63300 1.50500 -0.40700 1.000 C30 C 10.25600 -0.84500 -0.06200 1.000 C31 C -2.43200 -0.14700 0.64100 1.000 C32 C -1.63300 2.31400 -0.63700 1.000 C33 C -3.04800 2.16500 -0.07000 1.000 C34 C -0.67800 1.41400 0.15200 1.000 C35 C -3.45700 0.69000 -0.12800 1.000 H36 H -5.66100 1.70100 -0.97000 1.000 H37 H -7.96100 1.09700 -0.31600 1.000 H38 H -6.85000 2.78600 0.95900 1.000 H39 H -6.60700 -0.66100 1.78400 1.000 H40 H -8.70300 0.29400 2.42600 1.000 H41 H -8.27700 -1.40500 -0.66400 1.000 H42 H -8.43900 -2.90100 1.19300 1.000 H43 H -5.30700 -1.80300 -0.08000 1.000 H44 H -6.43300 -3.62500 -1.39400 1.000 H45 H -6.95700 -2.40100 -2.57600 1.000 H46 H -4.88600 -3.41400 -3.20200 1.000 H47 H -2.07400 -3.35200 1.31300 1.000 H48 H -0.32400 3.84200 -0.86200 1.000 H49 H -3.75600 3.89000 -0.86000 1.000 H50 H 5.35400 -0.03700 -1.27600 1.000 H51 H 5.67300 1.41200 -0.29300 1.000 H52 H 3.78900 -0.86900 0.45800 1.000 H53 H 4.10800 0.58100 1.44100 1.000 H54 H 6.53100 -0.02000 1.54000 1.000 H55 H 6.21200 -1.46900 0.55800 1.000 H56 H 13.16100 0.23300 1.07100 1.000 H57 H 14.04900 0.04200 -0.46000 1.000 H58 H 3.25000 2.01300 -0.39300 1.000 H59 H 2.93100 0.56300 -1.37500 1.000 H60 H 7.77800 -0.63700 -1.17600 1.000 H61 H 8.09600 0.81200 -0.19400 1.000 H62 H 12.57600 -1.85400 -1.07700 1.000 H63 H 13.39600 -2.16200 0.47200 1.000 H64 H 12.34500 1.83500 -0.63700 1.000 H65 H 11.96200 0.47900 -1.72500 1.000 H66 H 1.36600 -0.26900 0.35900 1.000 H67 H 1.68400 1.18100 1.34200 1.000 H68 H -2.73300 -1.94700 -0.50300 1.000 H69 H -3.81900 -1.77500 0.89600 1.000 H70 H 8.95400 -0.62000 1.64000 1.000 H71 H 8.63600 -2.06900 0.65700 1.000 H72 H 10.99300 -2.75700 0.60400 1.000 H73 H 11.37600 -1.40100 1.69200 1.000 H74 H 10.76200 0.93200 1.04500 1.000 H75 H 9.94200 1.24000 -0.50400 1.000 H76 H 10.17700 -1.15500 -1.10400 1.000 H77 H -2.43000 0.15400 1.68900 1.000 H78 H -1.62900 2.01900 -1.68700 1.000 H79 H -3.06500 2.50800 0.96400 1.000 H80 H -0.65300 1.73600 1.19300 1.000 H81 H -3.49100 0.36200 -1.16700 1.000