PUBCHEM-ZINC05573486 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 -0.5140 2.1470 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 0.6660 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.1460 0.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0470 -0.6390 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7800 -0.4580 -2.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -1.5110 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2380 -1.2270 0.9800 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2970 -2.1610 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -0.4940 1.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -0.2260 2.3840 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 -0.1680 1.3860 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.8820 -0.8120 0.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6730 -0.5260 3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7040 0.3170 3.9410 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7100 1.3300 3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1060 -0.2860 3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 0.3810 5.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5030 -0.4620 5.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7870 1.4020 6.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6410 2.5100 5.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 3.5500 6.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2350 2.7030 8.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 1.4680 7.6240 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3930 1.6060 7.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9360 0.2620 8.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0240 -0.2870 8.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 2.7450 -0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 2.3720 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0550 2.4620 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 0.3800 -0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 0.4710 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -1.2960 -1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 -2.5530 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -1.5990 3.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 -0.2950 3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1200 -1.3130 4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8310 0.2830 4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4670 -0.3000 2.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3900 2.8880 4.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6770 2.1570 5.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4980 4.1130 6.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2440 4.2600 6.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6800 3.2370 8.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2170 2.4430 8.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1780 -0.0040 9.4600 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 M CHG 1 45 -1 M END