IFLAB-ZINC04303800 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 1 0 0 0 0 0999 V2000 0.6370 0.1350 -1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -0.6940 -0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5690 -0.2290 0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1030 1.0610 0.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 1.9320 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 1.4270 -1.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 3.2160 -0.3430 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 3.8110 -1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 4.3130 -1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9100 4.5360 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 4.0580 0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9220 5.7980 0.1110 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5240 4.9030 0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9950 6.7520 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3160 7.3070 1.5920 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3680 6.5070 1.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3050 5.2890 2.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6340 7.2360 2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3520 7.0540 3.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6960 8.3650 3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4530 6.4920 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8590 7.6790 -1.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 8.2850 -2.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 7.6880 -3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9720 6.5400 -2.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5380 5.9220 -1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9870 6.1080 -3.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9670 7.1120 -4.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9610 8.1260 -4.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 1.4440 1.8280 F 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -0.2200 -2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4110 -1.6960 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -0.8630 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 2.0520 -2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 3.1010 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3370 4.6450 -1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 3.4820 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7500 4.8670 -2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8890 5.2510 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5850 3.7050 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 4.9310 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 3.5690 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 7.5960 1.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7210 6.2160 2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4700 8.3060 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2700 7.3120 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8940 6.4230 4.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4350 7.0110 3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3400 9.2090 3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8070 8.6230 3.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 8.1440 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8800 9.1930 -3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0280 5.0160 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9490 7.5960 -4.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7780 6.6210 -5.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 5.2570 -0.1030 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8760 6.0590 -0.3100 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 9 56 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 10 56 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 12 56 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END