PUBCHEM-ZINC05999180 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -0.6060 -1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 0.1590 -2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -0.4620 -3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -1.8570 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -2.6220 -2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6660 -2.0050 -1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -2.7580 -0.1380 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2910 -3.3330 0.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 0.3550 -4.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 1.5680 -4.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 -0.2450 -5.2710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 1.2370 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -2.3360 -4.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -3.6990 -2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0210 -1.2130 -5.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 0.2920 -5.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 9 10 3 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 20 1 0 0 0 0 13 21 1 0 0 0 0 M CHG 1 9 1 M END