# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common '0KO' 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 -3.92900 6.37300 -0.22800 1.000 O1 O -4.76900 5.40500 0.40300 1.000 C2 C -4.40100 4.10300 0.29300 1.000 C3 C -5.18200 3.11700 0.88200 1.000 C4 C -4.79900 1.79300 0.76400 1.000 N5 N -3.30600 3.78900 -0.37800 1.000 C6 C -2.90900 2.53800 -0.51200 1.000 C7 C -3.63500 1.50000 0.05400 1.000 N8 N -3.20800 0.17400 -0.09200 1.000 C9 C -1.94100 -0.09600 -0.58400 1.000 N10 N -1.18500 0.89400 -1.03300 1.000 C11 C 0.02600 0.68100 -1.50900 1.000 C12 C 0.56000 -0.59300 -1.56200 1.000 C13 C 1.94600 -0.81300 -2.11100 1.000 N14 N 2.92600 -0.71500 -1.02100 1.000 C15 C 2.97100 0.64700 -0.47400 1.000 C16 C 3.86500 0.66600 0.77000 1.000 C17 C 4.25500 -1.15500 -1.46600 1.000 C18 C 5.20100 -1.21100 -0.26200 1.000 N19 N 5.17300 0.09400 0.41500 1.000 S20 S 6.57600 0.89900 0.76900 1.000 C21 C 7.03000 0.31200 2.42400 1.000 O22 O 7.50400 0.42900 -0.20000 1.000 O23 O 6.19400 2.26700 0.81300 1.000 C24 C -0.18800 -1.66500 -1.10600 1.000 C25 C -1.46600 -1.41600 -0.60000 1.000 C26 C -2.30500 -2.52400 -0.09400 1.000 N27 N -3.49700 -2.26900 0.43800 1.000 N28 N -1.87100 -3.78200 -0.17600 1.000 C29 C -2.62000 -4.77200 0.27600 1.000 C30 C -2.12500 -6.19200 0.18200 1.000 N31 N -3.80200 -4.52000 0.81000 1.000 C32 C -4.24600 -3.26800 0.89100 1.000 N33 N -5.48300 -3.00800 1.44500 1.000 H34 H -3.88300 6.17200 -1.29800 1.000 H35 H -4.33600 7.37100 -0.06300 1.000 H36 H -2.92600 6.31600 0.19600 1.000 H37 H -6.07700 3.38100 1.42500 1.000 H38 H -5.38600 1.00500 1.21100 1.000 H39 H -2.00900 2.31900 -1.06700 1.000 H40 H -3.79900 -0.55500 0.15200 1.000 H41 H 0.61100 1.51700 -1.86500 1.000 H42 H 2.00500 -1.80300 -2.56500 1.000 H43 H 2.16400 -0.05500 -2.86400 1.000 H44 H 3.37800 1.32700 -1.22400 1.000 H45 H 1.96400 0.96500 -0.20400 1.000 H46 H 3.99400 1.69200 1.11300 1.000 H47 H 3.40700 0.06900 1.55900 1.000 H48 H 4.17900 -2.14500 -1.91500 1.000 H49 H 4.64300 -0.45100 -2.20200 1.000 H50 H 4.87100 -1.98800 0.42700 1.000 H51 H 6.21400 -1.42800 -0.60200 1.000 H52 H 7.95400 0.79500 2.74000 1.000 H53 H 6.23400 0.55400 3.12700 1.000 H54 H 7.17600 -0.76800 2.39800 1.000 H55 H 0.20800 -2.66900 -1.13800 1.000 H56 H -1.56800 -6.44300 1.08400 1.000 H57 H -2.97400 -6.86700 0.07900 1.000 H58 H -1.47400 -6.29300 -0.68700 1.000 H59 H -5.80600 -2.09600 1.50400 1.000 H60 H -6.03000 -3.73900 1.77500 1.000