PUBCHEM-ZINC04877552 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 0.2030 1.2490 -0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 -0.1320 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0630 -0.9950 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 -0.4910 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 0.8930 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 1.7740 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 3.1790 0.1140 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 3.9310 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 3.4850 0.7140 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 5.4270 0.6130 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4950 5.6380 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8520 5.6820 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9900 5.7010 3.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 6.6920 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 6.4390 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 6.3880 0.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0440 7.3970 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 6.1570 -1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 5.5290 -1.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7900 -2.7450 -0.1680 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 -3.4250 0.0170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -3.0000 0.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -3.0320 -1.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -2.8970 -2.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -3.1820 -3.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -2.9950 -5.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -2.5730 -4.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -2.4030 -2.9640 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 1.9090 -0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -0.5160 -0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 -1.1540 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5040 1.2540 0.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 3.7030 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 6.6510 2.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 4.9270 2.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5920 5.9660 4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 4.6980 3.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 7.7110 2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9040 6.6360 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3190 7.2370 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1890 5.5090 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -3.3260 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -3.1840 -6.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -2.3630 -5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 6.6600 -1.4840 O 0 5 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 28 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 M CHG 1 45 -1 M END