IBS-ZINC01185627 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3800 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -0.6870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 2.1670 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 1.5330 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 2.2500 -0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1650 1.5920 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1810 0.3750 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4260 2.3430 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6430 1.7860 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7210 2.6880 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1090 2.4120 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0140 3.4260 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5950 4.7510 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2540 5.0510 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3040 4.0240 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5450 4.0930 -0.0600 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8750 0.0660 -0.0820 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.5810 -0.6580 -0.0330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5170 -2.0860 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9140 -2.6510 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -1.9080 -0.0590 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5540 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -1.7670 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 3.2470 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 3.2200 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4520 1.3880 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0700 3.2000 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3250 5.5470 -0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9330 6.0820 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9950 -2.4300 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9800 -2.4210 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 -3.9800 -0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0140 -4.2960 -0.0720 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 31 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 20 1 0 0 0 0 13 14 1 0 0 0 0 13 21 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 38 39 1 0 0 0 0 M END