PUBCHEM-ZINC01187319 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 1.0380 0.1690 -3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5160 -0.7580 -2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -0.9020 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -0.1620 -1.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1570 -0.1420 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 0.7670 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9520 1.3040 -1.5370 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8590 0.7330 -1.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 0.8820 -3.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2450 1.1510 0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7200 0.2970 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7780 0.6880 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3670 1.9390 2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9070 2.8130 1.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8520 2.4070 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5580 4.0610 1.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2540 5.1180 0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2900 5.1650 -0.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 6.3030 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1710 7.0380 -0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9490 8.1820 -1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7750 8.6190 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8040 7.8990 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0180 6.7460 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0670 6.0840 2.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1800 4.8170 2.6570 O 0 5 0 0 0 0 0 0 0 0 0 0 10.7490 8.3670 2.1220 N 0 3 0 0 0 0 0 0 0 0 0 0 10.6060 9.5280 2.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6890 7.6100 2.4050 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4920 0.2710 -4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -1.3100 -2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -1.5700 -0.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 -0.7480 0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 1.5730 -3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 -0.6860 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1440 0.0210 3.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 2.2340 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4820 3.0580 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3620 4.1940 1.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5340 6.7170 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9080 8.7200 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3930 9.5020 -0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9790 6.8330 3.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 9 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 27 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 43 2 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 26 -1 M CHG 1 27 1 M CHG 1 29 -1 M END