IFLAB-ZINC01687032 MOE2007 3D CORINA 3.40 0006 02.08.2006 22 22 0 0 0 0 0 0 0 0999 V2000 -0.0320 1.3450 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.0310 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -0.6730 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 0.0620 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 1.4380 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 2.0800 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6370 2.2390 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 2.5580 -1.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4060 2.1750 -2.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3090 3.3470 -1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9730 3.7310 -0.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -0.6260 -0.1850 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6320 -0.1160 -0.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8810 -1.7020 0.3630 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9860 1.8470 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -0.6050 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -1.7480 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 3.1550 0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 3.1660 0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 1.6590 0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 3.6320 -2.8470 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5060 4.1460 -2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 15 1 0 0 0 0 2 3 2 0 0 0 0 2 16 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 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 7 20 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 21 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END