# CIF file generated by openbabel 2.4.1, see http://openbabel.sf.net data_I _chemical_name_common 'CDM' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy N0 N -0.82200 -0.49800 -5.72500 1.000 C1 C -1.53000 0.56700 -5.30900 1.000 N2 N -2.75700 0.80100 -5.77100 1.000 C3 C -3.31800 -0.02000 -6.64900 1.000 C4 C -2.60500 -1.14900 -7.10100 1.000 C5 C -1.35600 -1.37000 -6.62600 1.000 O6 O -1.03600 1.33700 -4.50200 1.000 N7 N -4.58800 0.22800 -7.11500 1.000 C8 C 0.52700 -0.72600 -5.20300 1.000 C9 C 1.42600 0.51200 -5.44700 1.000 O10 O 2.02500 0.45900 -6.74400 1.000 C11 C 2.49900 0.35800 -4.33700 1.000 C12 C 1.83100 -0.56100 -3.29700 1.000 O13 O 0.50200 -0.84600 -3.76400 1.000 O14 O 3.68100 -0.24600 -4.86400 1.000 C15 C 1.76500 0.14700 -1.94200 1.000 O16 O 1.13800 -0.70900 -0.98600 1.000 P17 P 1.10200 0.09500 0.40700 1.000 O18 O 2.48400 0.42300 0.82200 1.000 O19 O 0.26100 1.45400 0.22000 1.000 O20 O 0.40500 -0.81600 1.53500 1.000 P21 P 0.40300 0.04500 2.89500 1.000 O22 O -0.42600 1.40500 2.66700 1.000 O23 O 1.79600 0.37400 3.27200 1.000 O24 O -0.28300 -0.81000 4.07300 1.000 C25 C -0.25400 0.00300 5.24600 1.000 C26 C -0.89600 -0.75500 6.41000 1.000 O27 O -0.16900 -1.96100 6.65000 1.000 C28 C -0.86500 0.11700 7.66600 1.000 C29 C -1.50700 -0.64100 8.83000 1.000 C30 C 0.58400 0.45600 8.01700 1.000 O31 O -1.59200 1.32300 7.42600 1.000 O32 O -1.47800 0.17300 10.00300 1.000 H33 H -3.04800 -1.82700 -7.81600 1.000 H34 H -0.79000 -2.22800 -6.95700 1.000 H35 H -5.07600 1.00600 -6.80200 1.000 H36 H -4.99500 -0.37300 -7.75800 1.000 H37 H 0.96700 -1.61500 -5.65500 1.000 H38 H 0.86100 1.43400 -5.31900 1.000 H39 H 2.56900 1.25400 -6.83300 1.000 H40 H 2.73200 1.32700 -3.89500 1.000 H41 H 2.39800 -1.48700 -3.20300 1.000 H42 H 4.01800 0.34600 -5.54900 1.000 H43 H 1.18700 1.06600 -2.04100 1.000 H44 H 2.77400 0.38700 -1.60800 1.000 H45 H -0.63000 1.19600 -0.04900 1.000 H46 H -1.32500 1.14700 2.42300 1.000 H47 H -0.80900 0.92400 5.06300 1.000 H48 H 0.77800 0.24500 5.49600 1.000 H49 H -1.92900 -0.99600 6.16000 1.000 H50 H 0.73700 -1.70300 6.86700 1.000 H51 H -2.54000 -0.88300 8.58000 1.000 H52 H -0.95200 -1.56200 9.01300 1.000 H53 H 1.13900 -0.46300 8.20000 1.000 H54 H 1.04100 0.99700 7.18800 1.000 H55 H 0.60600 1.07800 8.91200 1.000 H56 H -2.49900 1.06500 7.21000 1.000 H57 H -1.89100 -0.34100 10.71100 1.000