PUBCHEM-ZINC02885325 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 -0.6440 1.8530 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 0.3710 0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -0.4450 1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -1.7820 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -1.7690 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -0.4390 -0.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 0.0110 -2.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 1.0990 -2.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 1.5410 -3.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 0.8900 -4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -0.1900 -4.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -0.6310 -2.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 1.4840 -6.2780 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7650 1.0920 -6.3430 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 2.9230 -6.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 0.7350 -7.3190 N 0 5 0 0 0 0 0 0 0 0 0 0 -1.6470 -0.2360 -7.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -2.9270 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -2.9750 1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -3.1760 2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7690 -2.1780 3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -1.3720 3.6150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9230 -4.5260 3.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -5.3210 3.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -6.6090 3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -7.1320 4.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -6.3250 4.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 -5.0370 4.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0440 -8.5310 4.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -9.1990 4.8040 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2520 2.3530 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 2.1760 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 2.1990 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -0.0840 2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 1.5920 -2.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3060 2.3790 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -0.6790 -4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -1.4480 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -3.3180 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -2.6550 -2.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -3.7430 -1.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -3.8330 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -4.9560 2.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -7.2170 3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -6.7100 5.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -4.4420 4.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -8.9360 5.5950 O 0 0 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 6 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 19 1 0 0 0 0 5 6 1 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 3 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 2 0 0 0 0 M CHG 1 16 -1 M CHG 1 30 -1 M END