CHEMDIV-ZINC06998156 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.1220 1.5800 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 0.1050 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.4270 0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -1.7930 1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -2.6130 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -2.1160 -1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -0.7360 -1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 -3.2250 -2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 -3.3640 -3.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2800 -4.5250 -4.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -5.6610 -3.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -5.6510 -2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 -6.6420 -1.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5190 -4.3430 -1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8520 -3.9730 -0.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -4.6030 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -6.9150 -4.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -7.4520 -4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -7.4950 -3.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 -7.8860 -5.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -8.4370 -5.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0850 -8.6250 -4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3070 -9.1730 -5.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4990 -9.5290 -6.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4900 -9.3570 -7.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2720 -8.8080 -6.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0680 -10.2610 -6.9370 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.6780 -11.1040 -8.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4720 -10.9930 -5.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0100 -9.0380 -7.3210 N 0 5 0 0 0 0 0 0 0 0 0 0 -7.5920 -8.6050 -8.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 2.0890 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 1.7810 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 2.0050 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 0.2260 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -2.1920 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -0.3260 -2.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 -2.4710 -4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -6.7340 -5.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -7.6630 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -7.7990 -6.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -8.3540 -3.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0990 -9.3170 -4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6470 -9.6460 -8.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -8.6760 -7.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 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 6 8 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 41 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 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 30 -1 M END