PUBCHEM-ZINC04823322 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 62 0 0 1 0 0 0 0 0999 V2000 0.4870 2.1710 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 0.8870 -1.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -0.0910 -1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 0.2830 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 1.6410 -0.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 2.6430 -0.6390 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 1.7180 0.2650 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 0.4340 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 -0.4600 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4070 2.9280 0.6690 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9190 3.7780 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 3.1010 2.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6870 2.1070 2.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8690 3.8390 2.3060 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3520 3.7330 3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6860 3.2130 1.1850 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1130 2.2600 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7550 2.8700 0.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7890 4.1230 0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6770 3.3380 -0.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8120 3.9680 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1480 5.1000 -0.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6500 3.0330 -1.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7900 3.7790 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7060 2.7350 -2.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9050 1.9010 -3.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3270 2.8350 -4.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4070 3.8820 -4.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2180 4.7020 -3.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2600 3.1660 -3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8230 2.2280 -2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7470 1.1910 -3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6450 5.2380 2.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6880 5.2840 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5730 3.9040 2.6740 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6520 -1.4060 -1.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 2.9220 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 0.2160 0.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3690 4.9200 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3590 4.5500 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1060 2.3300 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3780 4.3760 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5410 3.2380 -3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1450 2.0780 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5610 1.1590 -4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1410 3.3350 -5.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7650 2.2520 -5.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9980 4.5450 -5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5850 5.4800 -2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0380 5.2220 -3.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5810 3.9030 -3.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6650 2.5880 -4.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9950 1.7000 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1750 0.5870 -3.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1430 0.5000 -2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2480 -1.6020 -1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 -2.1360 -1.0260 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 37 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 35 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 33 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 29 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 32 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 33 34 1 0 0 0 0 36 56 1 0 0 0 0 36 57 1 0 0 0 0 M CHG 1 35 -1 M END