IFLAB-ZINC04279130 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 -0.7580 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3670 -1.2360 -1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0070 -1.4830 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 -1.2490 1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0460 -0.7760 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -1.9530 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8790 -2.1850 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3040 -2.7080 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2610 -3.9880 0.4960 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5470 -4.5690 0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3800 -5.9290 -0.4090 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7190 -6.5560 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7460 -6.6060 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8670 -8.6420 -1.2180 C 0 0 3 0 0 0 0 0 0 0 0 0 -11.5240 -8.3420 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5060 -8.2590 -2.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6530 -10.1560 -1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1300 -10.5540 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8160 -5.7460 -1.7090 O 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 0.5120 -0.3560 -0.8950 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 -1.5720 -0.5650 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8810 -1.4170 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8400 -1.4410 2.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -0.5980 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2910 -2.9220 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9060 -1.2510 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7890 -2.8000 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8660 -2.0130 0.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0580 -4.7000 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1350 -3.9120 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2160 -6.6660 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3790 -6.0240 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4660 -8.7650 -2.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6590 -7.1800 -2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8490 -8.5580 -3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5990 -10.6630 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9270 -10.4440 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9780 -11.6330 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1840 -10.0470 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8560 -10.2660 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3520 -5.1960 -2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5730 -7.9600 -1.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0820 -7.9360 -1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 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 14 22 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 17 49 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 49 50 1 0 0 0 0 M END