PUBCHEM-ZINC06095753 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 0.0590 1.3610 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0980 -0.0300 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -0.6890 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 0.0400 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 1.4370 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 2.0930 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8040 -0.7090 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 -1.8890 0.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0900 0.0420 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 -1.0920 -0.3580 S 0 0 0 0 0 0 0 0 0 0 0 0 7.8040 0.0830 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1230 -0.3270 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0900 0.6650 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8930 1.9620 -0.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5900 2.2320 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5420 1.3850 -0.7600 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2710 0.0370 -0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9900 -1.2900 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7040 -1.5450 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5760 0.6620 0.0460 C 0 0 3 0 0 0 0 0 0 0 0 0 12.5160 1.6580 -0.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1570 0.6850 1.4820 C 0 0 3 0 0 0 0 0 0 0 0 0 13.0070 -0.3100 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6560 0.7900 1.1560 C 0 0 3 0 0 0 0 0 0 0 0 0 15.3060 0.4540 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8120 -0.0170 -0.1270 C 0 0 3 0 0 0 0 0 0 0 0 0 15.4790 0.4710 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5080 -0.1060 -0.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2780 -1.4480 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4220 -2.1370 -1.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6230 -1.9070 -1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9670 2.1690 0.9080 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2310 2.5910 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7830 1.7830 2.1300 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8960 1.8740 -0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 -0.6020 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -1.7760 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 2.0460 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 3.1790 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 0.6300 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 0.6960 0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3520 3.2650 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7590 -2.0150 0.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2450 -1.4650 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5500 -2.0050 0.7340 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 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 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 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 34 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 M CHG 1 34 -1 M END