IFLAB-ZINC00936720 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 27 0 0 0 0 0 0 0 0999 V2000 0.1980 1.4830 1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 0.0850 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2740 -0.6680 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3620 0.0210 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 1.4190 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 2.1470 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 3.6200 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 4.2810 -0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1970 5.6690 -0.1360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 6.4370 0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 6.0960 1.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 7.9080 0.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 8.4570 -0.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8860 7.6320 -1.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 8.0900 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9280 6.2590 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8410 5.4590 -2.3360 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2630 -2.1830 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 -2.7330 1.2630 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6550 2.0310 1.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 -0.4280 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -0.5400 -0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 1.9210 -0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 4.1000 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 8.5200 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -2.7890 0.3030 O 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 20 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 18 1 0 0 0 0 4 5 2 0 0 0 0 4 22 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 24 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 26 2 0 0 0 0 M CHG 1 19 -1 M END