IBS-ZINC01698345 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.1090 1.6620 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0470 0.1900 0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -0.3050 1.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 -0.4940 -1.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -1.9310 -0.9860 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7300 -2.2200 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6810 -2.4410 -2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -3.9680 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -4.6410 -2.1160 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4520 -6.1780 -1.8730 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3370 -6.2310 -1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -7.0060 -3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 -8.4240 -2.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -9.0200 -1.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7160 -8.3580 -1.4270 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1810 -8.5210 -2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -6.8300 -1.2760 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5930 -6.5080 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -6.2620 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8710 -4.7580 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -4.0180 -0.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -2.5090 -0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 -9.2280 -0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 -10.6530 -0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -10.5190 -1.6050 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0890 -11.1450 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -11.1720 -2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -10.4090 -3.8350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -8.8720 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -4.3910 -3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 1.9750 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 1.8960 -0.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 2.2040 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1310 -2.0350 -3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -2.0500 -2.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -4.2730 -3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -4.3140 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -7.0990 -3.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -6.5130 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -9.0650 -3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -8.3740 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9730 -6.5440 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -6.6640 0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 -4.2660 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7330 -2.1640 0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -2.0980 -1.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -8.9550 0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5910 -9.1610 -0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -11.1280 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7680 -11.2660 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -7.8390 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 -9.2580 0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -9.4350 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -4.7930 -4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5620 -4.8490 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -3.3240 -3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -12.4170 -3.0120 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 22 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 57 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 M CHG 1 57 -1 M END