PUBCHEM-ZINC03874920 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 49 0 0 1 0 0 0 0 0999 V2000 -0.0640 1.2770 0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1200 -0.0820 0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3890 -0.6510 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 0.1380 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 1.5050 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 2.0700 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 -0.4800 -0.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 -0.9020 -1.8430 S 0 0 0 0 0 0 0 0 0 0 0 0 5.7040 -1.9260 -1.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 -2.3080 -2.8860 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7670 -1.4080 -3.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6140 -3.1820 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5520 -4.4090 -2.4460 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7300 -2.4580 -2.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9700 -3.0550 -1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9820 -1.9890 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6130 -0.7930 -1.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5520 -3.0690 -3.7940 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 -2.9390 -5.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4240 -2.1940 -5.7390 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -3.8090 -5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 -3.7090 -7.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -4.5140 -8.1550 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6510 -5.5490 -7.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8970 -4.5220 -9.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -4.0890 -10.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 1.7190 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -0.6970 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 -1.7140 0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 2.1380 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8730 3.1300 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6200 0.2150 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9210 -1.3850 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3940 -1.3690 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3970 -2.8280 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7790 -1.4400 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7220 -3.7250 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4020 -3.6480 -2.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9060 -3.7350 -3.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -4.8490 -5.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6310 -3.4950 -5.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 -2.6580 -7.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 -4.0630 -7.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0340 -2.4350 -0.6770 O 0 5 0 0 0 0 0 0 0 0 0 0 4.9740 -4.9290 -10.1780 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3370 -3.9060 -7.9180 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0340 -3.8230 -8.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 -2.9510 -7.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -4.5190 -7.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 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 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 18 19 1 0 0 0 0 18 39 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 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 46 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 46 49 1 0 0 0 0 M CHG 1 44 -1 M CHG 1 45 -1 M CHG 1 46 1 M END