IFLAB-ZINC04279287 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 63 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -2.0270 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -2.5210 -2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -4.0510 -2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 -4.5110 -3.7080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 -5.9340 -3.8140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2170 -6.3570 -3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8400 -6.3140 -5.1610 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8610 -7.4000 -5.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 -5.7670 -5.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2460 -4.6790 -5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 -6.3160 -4.0430 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0730 -5.8890 -4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -5.9370 -2.7400 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3340 -4.8510 -2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0300 -6.4490 -2.7560 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 -6.5320 -1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 -6.0750 -0.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 -6.5100 0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0340 -7.2490 0.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5090 -6.0780 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1590 -7.7620 -4.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2530 -8.3440 -3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1080 -7.6670 -3.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4140 -9.8410 -3.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8920 -6.1840 -6.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8190 -5.3660 -6.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1010 -4.3350 -6.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5070 -5.7330 -8.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -5.7380 -6.2470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -6.3940 -6.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -7.4610 -6.2250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -5.8020 -7.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -2.3880 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 -2.4050 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -2.1600 -3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -2.1440 -2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0030 -4.4120 -1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -4.4280 -2.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0780 -7.6200 -1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -6.2120 -1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -6.7870 2.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3040 -6.0480 2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 -5.0870 2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9300 -10.1080 -4.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9970 -10.1830 -2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4320 -10.3130 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 -5.8300 -9.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2220 -4.9530 -8.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0320 -6.6800 -8.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -4.8860 -6.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -5.6750 -8.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6880 -6.4700 -8.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -4.8330 -7.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 3 42 1 0 0 0 0 4 5 1 0 0 0 0 4 43 1 0 0 0 0 4 44 1 0 0 0 0 5 6 1 0 0 0 0 5 45 1 0 0 0 0 5 46 1 0 0 0 0 6 7 1 0 0 0 0 6 47 1 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 18 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 24 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 49 1 0 0 0 0 19 50 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 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 35 63 1 0 0 0 0 M END