IFLAB-ZINC02722113 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 1 0 0 0 0 0999 V2000 0.4720 -0.1580 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2110 -0.9800 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -0.1360 -2.0700 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0430 0.7880 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -0.9090 -3.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 -0.4040 -4.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 -1.1130 -5.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -2.3270 -5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -2.8320 -4.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7930 -2.1200 -3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 0.1900 -2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7420 -0.3640 -2.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 1.0980 -1.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 1.3690 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4440 2.5780 -0.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 2.4110 -1.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4890 3.0980 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0470 1.0840 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8680 0.4630 -1.4250 N 0 3 0 0 0 0 0 0 0 0 0 0 4.8030 -0.8430 -1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9320 -1.5820 -1.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1800 -0.9710 -1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2360 0.3800 -1.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4440 -1.7660 -2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 3.8370 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1630 4.6600 0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4940 5.8340 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3900 6.1990 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9560 5.3840 -1.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 4.2110 -1.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 7.3570 0.1680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 7.6720 -0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 0.2140 0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 0.6840 0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -0.7850 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -1.8690 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -1.2790 -0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2310 0.5440 -3.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8110 -0.7190 -6.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -2.8810 -6.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 -3.7800 -4.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -2.5130 -2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 1.5640 -0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 -1.3220 -1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8590 -2.6360 -2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1880 0.8820 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7200 -1.7440 -3.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2470 -1.3330 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2780 -2.7980 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0210 4.3770 0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 6.4700 1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 5.6710 -1.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 3.5800 -2.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 7.7530 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 6.8830 -0.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 8.6190 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 50 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 31 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 M CHG 1 19 1 M END