# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '983' 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 6.97300 1.01900 -2.85100 1.000 C1 C 7.45700 0.91900 -4.14200 1.000 C2 C 7.69000 -0.32500 -4.69800 1.000 C3 C 7.43900 -1.46900 -3.96400 1.000 C4 C 6.95500 -1.36900 -2.67200 1.000 C5 C 6.72100 -0.12500 -2.11700 1.000 C6 C 6.19400 -0.01500 -0.70900 1.000 O7 O 4.74200 -0.00600 -0.73600 1.000 C8 C 4.11000 0.08800 0.44900 1.000 O9 O 4.75300 0.16000 1.47700 1.000 N10 N 2.76300 0.10200 0.49500 1.000 C11 C 2.07500 0.20400 1.78400 1.000 C12 C 1.95800 1.67600 2.18500 1.000 C13 C 3.33400 2.24300 2.42200 1.000 C14 C 4.03100 2.82200 1.37800 1.000 C15 C 5.29400 3.34200 1.59500 1.000 C16 C 5.85800 3.28400 2.85600 1.000 C17 C 5.16000 2.70600 3.89900 1.000 C18 C 3.89600 2.18900 3.68300 1.000 C19 C 0.67600 -0.40500 1.66600 1.000 S20 S 0.81700 -2.18400 1.33600 1.000 O21 O 1.35000 -2.40900 0.03800 1.000 O22 O 1.34000 -2.86100 2.47000 1.000 N23 N -0.74900 -2.71000 1.23200 1.000 C24 C -1.60100 -2.26100 0.12800 1.000 C25 C -1.90800 -3.44400 -0.79300 1.000 C26 C -2.68100 -2.95000 -2.01700 1.000 C27 C -0.59800 -4.09100 -1.24500 1.000 P28 P -3.15900 -1.59100 0.79600 1.000 O29 O -2.86200 -0.69600 1.93600 1.000 O30 O -4.09500 -2.80300 1.29400 1.000 C31 C -4.02400 -0.65100 -0.50500 1.000 C32 C -5.19600 0.11400 0.11200 1.000 C33 C -6.31800 -0.84500 0.41600 1.000 O34 O -6.19300 -2.02000 0.16400 1.000 O35 O -7.45700 -0.39400 0.96600 1.000 C36 C -5.68000 1.16100 -0.85900 1.000 C37 C -5.65700 2.49600 -0.50200 1.000 C38 C -6.14000 0.78600 -2.10700 1.000 C39 C -6.58300 1.74600 -2.99700 1.000 C40 C -6.56700 3.08100 -2.63900 1.000 C41 C -6.10100 3.45700 -1.39300 1.000 C42 C -6.07700 4.91200 -1.00400 1.000 N43 N -4.78800 5.50200 -1.39100 1.000 H44 H 6.79500 1.99100 -2.41500 1.000 H45 H 7.65300 1.81200 -4.71600 1.000 H46 H 8.06700 -0.40400 -5.70700 1.000 H47 H 7.62000 -2.44100 -4.39800 1.000 H48 H 6.75900 -2.26200 -2.09800 1.000 H49 H 6.54100 -0.86700 -0.12400 1.000 H50 H 6.55500 0.90800 -0.25700 1.000 H51 H 2.24900 0.04500 -0.32600 1.000 H52 H 2.64300 -0.33500 2.54300 1.000 H53 H 1.46800 2.23200 1.38600 1.000 H54 H 1.36900 1.75800 3.09900 1.000 H55 H 3.59100 2.86800 0.39300 1.000 H56 H 5.83900 3.79400 0.78000 1.000 H57 H 6.84400 3.69000 3.02500 1.000 H58 H 5.60100 2.66000 4.88400 1.000 H59 H 3.34900 1.74100 4.50000 1.000 H60 H 0.13200 -0.25000 2.59700 1.000 H61 H 0.13900 0.07500 0.84700 1.000 H62 H -1.10300 -3.31500 1.90200 1.000 H63 H -1.08500 -1.48500 -0.43700 1.000 H64 H -2.50900 -4.17700 -0.25500 1.000 H65 H -2.15000 -2.11200 -2.46900 1.000 H66 H -2.76900 -3.75900 -2.74300 1.000 H67 H -3.67700 -2.62600 -1.71200 1.000 H68 H -0.05200 -4.45300 -0.37400 1.000 H69 H -0.81600 -4.92800 -1.90900 1.000 H70 H 0.00800 -3.35600 -1.77400 1.000 H71 H -4.33000 -3.43000 0.59700 1.000 H72 H -3.33200 0.05400 -0.96500 1.000 H73 H -4.39800 -1.33900 -1.26300 1.000 H74 H -4.87100 0.59600 1.03400 1.000 H75 H -8.14800 -1.04700 1.14200 1.000 H76 H -5.29400 2.78900 0.47200 1.000 H77 H -6.15200 -0.25700 -2.38700 1.000 H78 H -6.94200 1.45300 -3.97300 1.000 H79 H -6.91200 3.83200 -3.33400 1.000 H80 H -6.88500 5.43800 -1.51400 1.000 H81 H -6.20900 5.00300 0.07400 1.000 H82 H -4.74800 6.47800 -1.14000 1.000 H83 H -4.02000 4.99100 -0.98100 1.000