IBS-ZINC04040157 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 -2.2990 -0.9980 0.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -1.1050 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -1.0460 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 -1.1890 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -1.3280 -0.7810 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -1.4460 -1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -1.2850 -0.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -1.4080 -2.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -1.3510 -2.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -1.5830 -3.4160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -1.6960 -4.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -1.1870 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -0.8660 2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -2.0640 3.5460 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4940 -1.6700 4.9490 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7460 -0.6100 4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -1.9410 5.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -2.4350 5.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 -2.7430 5.7650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -2.5580 3.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 -2.9680 2.9260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 -1.7030 7.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -0.2810 7.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -0.0520 9.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 1.2170 9.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6970 -2.4950 5.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 -2.0930 5.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -3.1750 5.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -4.1730 6.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6720 -3.7530 5.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 0.2470 3.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 0.0480 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -1.5750 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -1.3870 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 -1.8340 -5.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -2.5520 -4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -0.7880 -4.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0080 -2.1900 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -0.8780 0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7760 -0.4920 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -2.4190 7.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 -1.8220 7.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 0.4350 7.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -0.1620 7.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 0.7300 9.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -1.0220 9.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 0.1270 10.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6950 1.1700 9.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 2.0450 8.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 1.3690 10.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3350 -1.1290 4.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8490 -3.1960 5.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -5.1460 6.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 -2.8580 3.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9800 -0.0420 9.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 12 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 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 31 2 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 14 54 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 26 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 55 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 55 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 55 1 0 0 0 0 26 27 2 0 0 0 0 26 30 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 M END