IBS-ZINC02197780 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 1.3200 1.1040 -0.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -0.2520 -0.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -0.7480 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 -0.0640 1.3690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 -2.1110 0.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -2.7940 0.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 -2.1650 -0.8760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -2.9180 -1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4730 -4.2920 -1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -5.0340 -2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8610 -4.4120 -3.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7460 -3.0450 -3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -2.2940 -2.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -0.5770 -3.0490 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.8270 2.4550 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -4.4060 2.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -4.8390 1.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -6.0350 1.6830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -6.4540 2.7890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -5.4140 3.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -5.4130 4.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -6.0810 5.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -6.0780 6.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0680 -5.4120 6.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -4.7450 5.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7900 -4.7500 4.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4080 1.1620 -0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 1.3770 -1.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 1.7890 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 -1.2060 -0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9770 -4.7790 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 -6.1020 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 -4.9950 -4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2430 -2.5620 -4.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -6.6010 5.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -6.5980 7.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6530 -5.4110 7.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4780 -4.2250 5.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 -4.2340 3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 24 25 2 0 0 0 0 24 37 1 0 0 0 0 25 26 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 M END