# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CMJ' 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 24.28200 -0.04500 0.79900 1.000 C1 C 21.78700 -0.11300 0.67600 1.000 C2 C 20.54300 0.60300 0.14700 1.000 C3 C 19.29300 -0.18000 0.55300 1.000 C4 C -25.62500 -0.01600 0.73800 1.000 C5 C -24.37700 0.70500 0.22300 1.000 C6 C -23.12900 -0.07400 0.64300 1.000 C7 C -21.88100 0.64700 0.12800 1.000 C8 C -20.63300 -0.13200 0.54800 1.000 C9 C -19.38500 0.58900 0.03300 1.000 C10 C -18.13700 -0.19000 0.45300 1.000 C11 C -16.88900 0.53100 -0.06200 1.000 C12 C -15.64100 -0.24800 0.35800 1.000 C13 C -14.39300 0.47300 -0.15700 1.000 C14 C -13.14500 -0.30600 0.26300 1.000 C15 C -11.89700 0.41500 -0.25200 1.000 C16 C -10.64900 -0.36300 0.16800 1.000 C17 C -9.40100 0.35700 -0.34700 1.000 C18 C -8.15300 -0.42100 0.07200 1.000 C19 C -6.90500 0.29900 -0.44200 1.000 C20 C -5.65700 -0.47900 -0.02300 1.000 C21 C -4.40900 0.24200 -0.53800 1.000 C22 C -3.16100 -0.53700 -0.11800 1.000 C23 C -1.91300 0.18400 -0.63300 1.000 C24 C -0.66500 -0.59500 -0.21300 1.000 C25 C 0.58300 0.12600 -0.72800 1.000 C26 C 1.83100 -0.65300 -0.30800 1.000 C27 C 1.83800 -2.01700 -1.00000 1.000 C28 C 3.08100 0.13100 -0.71400 1.000 C29 C 4.32600 -0.58500 -0.18500 1.000 C30 C 5.57600 0.19800 -0.59100 1.000 C31 C 6.82000 -0.51800 -0.06200 1.000 C32 C 8.07000 0.26600 -0.46800 1.000 C33 C 9.31500 -0.45000 0.06100 1.000 C34 C 10.56500 0.33300 -0.34500 1.000 C35 C 11.80900 -0.38300 0.18400 1.000 C36 C 13.05900 0.40100 -0.22200 1.000 C37 C 14.30400 -0.31500 0.30700 1.000 C38 C 15.55400 0.46800 -0.09900 1.000 C39 C 16.79800 -0.24800 0.43000 1.000 C40 C 18.04800 0.53600 0.02400 1.000 C41 C 23.03800 0.67100 0.27000 1.000 C42 C 25.53200 0.73800 0.39300 1.000 H43 H 24.23000 -0.10900 1.88600 1.000 H44 H 24.33000 -1.04900 0.37800 1.000 H45 H 21.73600 -0.17700 1.76300 1.000 H46 H 21.83500 -1.11700 0.25500 1.000 H47 H 20.49500 1.60700 0.56900 1.000 H48 H 20.59500 0.66700 -0.93900 1.000 H49 H 19.34100 -1.18400 0.13200 1.000 H50 H 19.24100 -0.24400 1.64000 1.000 H51 H -25.58500 -0.08000 1.82600 1.000 H52 H -26.51400 0.53900 0.43900 1.000 H53 H -25.66400 -1.02000 0.31600 1.000 H54 H -24.41700 0.76800 -0.86400 1.000 H55 H -24.33800 1.70900 0.64500 1.000 H56 H -23.08900 -0.13800 1.73000 1.000 H57 H -23.16800 -1.07800 0.22100 1.000 H58 H -21.92100 0.71100 -0.95900 1.000 H59 H -21.84200 1.65100 0.55000 1.000 H60 H -20.59300 -0.19600 1.63500 1.000 H61 H -20.67200 -1.13600 0.12600 1.000 H62 H -19.42500 0.65300 -1.05400 1.000 H63 H -19.34600 1.59300 0.45500 1.000 H64 H -18.09700 -0.25400 1.54000 1.000 H65 H -18.17600 -1.19400 0.03100 1.000 H66 H -16.92900 0.59500 -1.14900 1.000 H67 H -16.85000 1.53500 0.36000 1.000 H68 H -15.60100 -0.31200 1.44500 1.000 H69 H -15.68000 -1.25200 -0.06400 1.000 H70 H -14.43300 0.53700 -1.24400 1.000 H71 H -14.35400 1.47700 0.26500 1.000 H72 H -13.10500 -0.36900 1.35000 1.000 H73 H -13.18400 -1.31000 -0.15900 1.000 H74 H -11.93700 0.47900 -1.33900 1.000 H75 H -11.85800 1.42000 0.17000 1.000 H76 H -10.60900 -0.42700 1.25500 1.000 H77 H -10.68800 -1.36800 -0.25400 1.000 H78 H -9.44100 0.42100 -1.43500 1.000 H79 H -9.36200 1.36200 0.07500 1.000 H80 H -8.11300 -0.48500 1.16000 1.000 H81 H -8.19200 -1.42600 -0.34900 1.000 H82 H -6.94500 0.36300 -1.53000 1.000 H83 H -6.86600 1.30400 -0.02100 1.000 H84 H -5.61700 -0.54300 1.06500 1.000 H85 H -5.69600 -1.48400 -0.44400 1.000 H86 H -4.44900 0.30600 -1.62500 1.000 H87 H -4.37000 1.24600 -0.11600 1.000 H88 H -3.12100 -0.60100 0.97000 1.000 H89 H -3.20000 -1.54100 -0.54000 1.000 H90 H -1.95300 0.24800 -1.72000 1.000 H91 H -1.87400 1.18800 -0.21100 1.000 H92 H -0.62500 -0.65900 0.87400 1.000 H93 H -0.70400 -1.59900 -0.63500 1.000 H94 H 0.54300 0.19000 -1.81500 1.000 H95 H 0.62200 1.13000 -0.30600 1.000 H96 H 1.82500 -0.79300 0.77300 1.000 H97 H 2.72700 -2.57200 -0.70100 1.000 H98 H 0.94700 -2.57600 -0.71100 1.000 H99 H 1.84300 -1.87700 -2.08100 1.000 H100 H 3.13300 0.19500 -1.80100 1.000 H101 H 3.03300 1.13500 -0.29200 1.000 H102 H 4.27400 -0.64900 0.90200 1.000 H103 H 4.37400 -1.58900 -0.60600 1.000 H104 H 5.62800 0.26200 -1.67800 1.000 H105 H 5.52800 1.20200 -0.16900 1.000 H106 H 6.76800 -0.58200 1.02500 1.000 H107 H 6.86800 -1.52200 -0.48300 1.000 H108 H 8.12200 0.33000 -1.55500 1.000 H109 H 8.02200 1.27000 -0.04600 1.000 H110 H 9.26300 -0.51400 1.14800 1.000 H111 H 9.36300 -1.45400 -0.36000 1.000 H112 H 10.61700 0.39700 -1.43200 1.000 H113 H 10.51700 1.33700 0.07700 1.000 H114 H 11.75700 -0.44700 1.27100 1.000 H115 H 11.85700 -1.38700 -0.23700 1.000 H116 H 13.11100 0.46500 -1.30900 1.000 H117 H 13.01100 1.40500 0.20000 1.000 H118 H 14.25200 -0.37900 1.39400 1.000 H119 H 14.35200 -1.31900 -0.11400 1.000 H120 H 15.60600 0.53200 -1.18600 1.000 H121 H 15.50600 1.47200 0.32300 1.000 H122 H 16.74700 -0.31200 1.51700 1.000 H123 H 16.84600 -1.25200 0.00900 1.000 H124 H 18.00000 1.54000 0.44600 1.000 H125 H 18.10000 0.60000 -1.06200 1.000 H126 H 22.99000 1.67500 0.69200 1.000 H127 H 23.08900 0.73500 -0.81700 1.000 H128 H 26.41900 0.22800 0.77000 1.000 H129 H 25.58400 0.80200 -0.69300 1.000 H130 H 25.48400 1.74300 0.81500 1.000