PUBCHEM-ZINC01092774 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.3800 2.0410 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 0.9100 -0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 0.1630 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 0.4980 -0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 1.6970 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 2.4400 -1.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1580 2.2090 -1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 1.7090 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0930 0.1960 -0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7410 -0.2600 -0.3260 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 -1.9880 -0.1760 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9310 -2.5090 0.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4720 -2.3590 0.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 -2.5260 -1.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 -2.7900 -2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 -3.2710 -4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -3.5180 -4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -3.2880 -3.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9880 -2.7880 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 -3.5720 -3.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5270 -2.7580 -3.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -4.7630 -4.4760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -5.3930 -4.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -6.4800 -5.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 -7.1710 -5.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -6.7980 -4.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5250 -5.7310 -3.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -5.0260 -3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 -5.3590 -3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4830 -4.5360 -2.1420 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.4670 2.6250 -2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 0.6030 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -0.6790 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8310 3.3440 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 1.8780 -2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 3.3060 -1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 2.0280 -1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9560 2.1380 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3280 -0.2270 -1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8460 -0.1510 -0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3890 -2.6330 -2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 -3.4630 -4.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 -3.8760 -5.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 -2.6290 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -5.2520 -4.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 -6.7990 -6.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5670 -8.0070 -6.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 -7.3520 -4.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -4.2130 -3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8160 -5.9070 -3.3550 O 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 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 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 2 0 0 0 0 M CHG 1 30 -1 M END