IFLAB-ZINC04854758 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1240 -0.9400 -1.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 -0.0450 -2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 -0.7510 -3.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 -1.9040 -3.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 -2.0140 -2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1560 -2.9570 -1.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3420 -2.8230 -4.6690 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7520 -3.7880 -4.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 -2.3780 -5.8740 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7090 -1.1950 -5.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3060 -0.8190 -6.8240 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7130 -0.4220 -4.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -3.0320 -5.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2440 -4.1870 -4.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -4.3810 -4.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -3.4160 -5.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9030 -2.2570 -6.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -2.0660 -5.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -3.6040 -6.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4520 0.9180 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9310 0.0910 -1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0730 -2.9220 -6.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1960 0.4190 -4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -4.9390 -4.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4100 -5.2840 -4.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3800 -1.5040 -6.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -1.1620 -6.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -3.2650 -5.4160 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END