IBS-ZINC04600404 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 0.0070 1.1060 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -0.3840 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6740 -0.6570 1.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -0.6900 2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -0.9700 3.2330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2710 -1.1120 2.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0060 -0.9360 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 -1.0390 -0.0680 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.4340 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 -1.5730 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5840 -0.4680 -0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6410 -0.5960 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9340 -1.8280 -1.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1700 -2.9320 -1.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1150 -2.8060 -0.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -0.4560 2.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 -0.8970 4.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -0.6760 4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -0.0160 3.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3990 0.4230 2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0930 0.2130 2.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4750 0.2590 4.1330 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 1.3840 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 1.3090 -1.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 1.6880 0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -0.6620 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -0.9660 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8790 -0.6340 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5280 -2.3710 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3550 0.4940 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2380 0.2670 -1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7600 -1.9270 -2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3980 -3.8940 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5200 -3.6690 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -1.4120 4.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -1.0170 5.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0840 0.9360 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7560 0.5610 1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 M END