IFLAB-ZINC05154644 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 28 0 0 0 0 0 0 0 0999 V2000 -2.6230 0.7650 1.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -0.5200 0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -1.3800 1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -1.0360 2.7970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -2.5270 1.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -3.1550 1.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -2.8510 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -2.0630 -1.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -0.8550 -0.6780 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2350 -4.0440 -0.4540 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -4.7620 -1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -4.3200 -2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -5.0850 -4.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -6.3010 -3.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -6.7600 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -6.0050 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1330 -6.5060 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 -5.7360 0.7850 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.8700 1.3950 1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 1.3040 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4280 0.5520 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -4.5970 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 -3.3780 -3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 -4.7240 -5.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -6.8930 -4.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4270 -7.7110 -2.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -7.6170 -0.1530 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 9 2 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 27 2 0 0 0 0 M CHG 1 18 -1 M END