PUBCHEM-ZINC04641533 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 0 0 0 0 0 0999 V2000 2.4440 0.9420 0.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7090 -0.3400 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3150 -1.1660 1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -2.2170 0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -3.2840 1.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -4.2080 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -5.2840 0.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -3.8510 -1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -4.6560 -2.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -4.5360 -3.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1410 -5.4050 -4.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -5.2850 -5.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -4.3010 -6.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -3.4410 -5.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6100 -3.5580 -3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -4.1690 -7.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2110 -4.9880 -8.4520 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2160 -2.6400 -1.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -2.2950 -3.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -1.9220 -0.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -0.7230 -0.9860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4020 0.8980 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 1.7690 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 1.1630 1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4250 -1.1130 2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8120 -5.5090 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -6.1770 -4.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0400 -5.9630 -6.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -2.6730 -5.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -2.8780 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -2.9510 -3.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5700 -3.2470 -7.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 32 2 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 M CHG 1 17 -1 M END