PUBCHEM-ZINC05849768 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 -1.7000 -1.1260 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8600 -2.9780 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -3.7750 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -5.0600 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -5.5850 -1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -4.8170 -2.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0700 -3.5090 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -2.5000 -3.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9250 -2.5520 -4.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 -1.4230 -2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3850 -0.1000 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9060 -0.1600 -2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 1.1830 -2.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9700 1.1260 -2.8170 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7220 2.2020 -3.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1900 3.2220 -3.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1790 2.1450 -2.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0450 3.1660 -3.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3600 2.8390 -3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5670 1.5950 -2.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0940 0.7490 -2.4200 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.5310 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -1.3390 0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -0.0810 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -3.3770 0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -5.6730 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -6.6030 -1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -5.2300 -3.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 0.6890 -2.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1340 0.1120 -3.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3050 -0.9480 -3.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1580 -0.3710 -1.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1150 1.9720 -2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2620 1.3950 -4.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3940 0.3130 -2.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7270 4.1330 -3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1680 3.5360 -3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5380 1.1800 -2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 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 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 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 M CHG 1 4 1 M END