# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'C84' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy O0 O 4.56600 -0.42400 1.43600 1.000 C1 C 3.80500 0.04100 0.31900 1.000 O2 O 2.42100 -0.35200 0.44800 1.000 C3 C 3.74500 1.59000 0.30600 1.000 C4 C 2.44700 1.85800 -0.49400 1.000 O5 O 1.71500 2.93800 0.08800 1.000 C6 C 1.65400 0.53800 -0.38100 1.000 N7 N 0.34900 0.78900 0.23500 1.000 C8 C 0.04500 0.67300 1.55900 1.000 N9 N -1.20600 0.97300 1.75600 1.000 C10 C -1.78300 1.30000 0.57500 1.000 C11 C -0.79100 1.19100 -0.41500 1.000 N12 N -1.10600 1.46300 -1.67700 1.000 C13 C -2.32800 1.82900 -2.00000 1.000 N14 N -3.29300 1.94500 -1.10600 1.000 C15 C -3.07200 1.69800 0.18100 1.000 N16 N -4.08800 1.82700 1.11200 1.000 C17 C 10.48300 -1.27500 -2.43500 1.000 C18 C 9.79900 0.07600 -2.21200 1.000 C19 C 9.43300 0.69200 -3.56300 1.000 C20 C 8.52800 -0.12700 -1.38300 1.000 O21 O 7.82500 1.11200 -1.27800 1.000 C22 C 8.90500 -0.62000 0.01500 1.000 O23 O 9.78900 0.32000 0.63000 1.000 C24 C 7.65900 -0.75800 0.85200 1.000 O25 O 7.49900 -0.05000 1.82300 1.000 N26 N 6.72300 -1.66900 0.52000 1.000 P27 P 5.36700 -1.82000 1.43000 1.000 O28 O 5.77300 -2.21200 2.93800 1.000 O29 O 4.50600 -2.88100 0.86100 1.000 P30 P -5.58600 2.29300 0.63100 1.000 O31 O -6.48400 2.35400 1.80600 1.000 O32 O -5.50100 3.74600 -0.05600 1.000 O33 O -6.16300 1.23000 -0.43100 1.000 C34 C -6.64900 -0.06000 -0.05500 1.000 C35 C -5.82800 -1.14300 -0.76200 1.000 O36 O -4.46900 -1.07200 -0.32700 1.000 C37 C -6.40700 -2.51700 -0.41300 1.000 O38 O -5.69300 -3.53100 -1.12400 1.000 C39 C -7.88400 -2.55600 -0.81100 1.000 C40 C -8.48600 -3.90500 -0.41200 1.000 O41 O -9.83200 -3.98600 -0.88600 1.000 O42 O -8.58400 -1.50500 -0.14200 1.000 C43 C -8.11800 -0.19400 -0.46500 1.000 O44 O -8.90000 0.77600 0.23400 1.000 H45 H 4.22500 -0.33400 -0.61400 1.000 H46 H 3.66600 1.98500 1.31900 1.000 H47 H 4.61200 2.00900 -0.20500 1.000 H48 H 2.68000 2.07400 -1.53700 1.000 H49 H 2.19200 3.77900 0.09400 1.000 H50 H 1.52100 0.10000 -1.37000 1.000 H51 H 0.74000 0.37500 2.33000 1.000 H52 H -2.55000 2.04300 -3.03500 1.000 H53 H -3.91500 1.64200 2.04800 1.000 H54 H 11.38800 -1.13000 -3.02500 1.000 H55 H 10.74300 -1.71300 -1.47200 1.000 H56 H 9.80500 -1.94200 -2.96700 1.000 H57 H 10.47600 0.74300 -1.68000 1.000 H58 H 8.82300 -0.01200 -4.13000 1.000 H59 H 8.87100 1.61200 -3.40300 1.000 H60 H 10.34300 0.91400 -4.12000 1.000 H61 H 7.89200 -0.86700 -1.86900 1.000 H62 H 8.33200 1.81800 -0.85400 1.000 H63 H 9.40100 -1.58800 -0.06100 1.000 H64 H 9.41300 1.20600 0.73000 1.000 H65 H 6.85100 -2.23600 -0.25700 1.000 H66 H 6.33900 -1.56000 3.37500 1.000 H67 H -4.92800 3.78000 -0.83500 1.000 H68 H -6.56000 -0.18300 1.02500 1.000 H69 H -5.87400 -0.98900 -1.84000 1.000 H70 H -3.89000 -1.73000 -0.73600 1.000 H71 H -6.31400 -2.69000 0.65900 1.000 H72 H -6.00700 -4.42900 -0.95000 1.000 H73 H -7.97300 -2.42400 -1.89000 1.000 H74 H -7.89700 -4.71000 -0.85100 1.000 H75 H -8.47700 -4.00000 0.67400 1.000 H76 H -10.27600 -4.81700 -0.66800 1.000 H77 H -8.21000 -0.03000 -1.53900 1.000 H78 H -9.84300 0.74800 0.02200 1.000