IBS-ZINC06719542 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0870 1.4750 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.0310 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -0.6690 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -2.1690 1.2910 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0270 -2.4540 1.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -2.7540 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -2.0550 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3740 -2.8700 -2.1900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -4.0910 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -4.0600 -0.4060 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -5.5090 -2.7080 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -4.8740 -4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 -0.7040 -1.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -2.6720 1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -3.3600 3.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -3.7170 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 -3.3190 2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 -2.4370 1.2580 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 0.1040 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 0.3730 2.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 0.5410 2.9860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7510 1.3780 4.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 2.3780 4.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 3.2020 5.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 3.0320 6.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 2.0380 6.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 1.2060 4.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 1.8760 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 1.8150 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 1.8240 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -4.4900 -4.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -4.0720 -4.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -5.6790 -5.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -0.2530 -1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 -3.6190 3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -4.2750 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 -3.5080 2.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 0.2760 2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 2.5100 3.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 3.9800 5.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 3.6780 7.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 1.9080 6.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 0.4270 4.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 19 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 M END