IFLAB-ZINC05252568 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -1.5880 0.9940 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 -0.4750 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -1.1190 0.9830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -1.0720 -1.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -0.2840 -2.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -1.0480 -3.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1590 -2.3840 -3.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8770 -3.1190 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8190 -2.4550 -1.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 -3.1580 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -4.5270 -0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3850 -5.1890 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -4.4870 -2.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0530 -5.2370 0.9830 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -6.2680 0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 -6.6400 -0.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1980 -6.9520 2.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -6.5800 3.2840 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0660 -7.9830 2.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 -8.6980 3.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5150 -8.0250 4.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 -8.7360 5.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 -10.1160 5.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -10.7890 4.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -10.0850 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -10.8060 2.0610 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2320 -12.0240 2.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -10.1820 1.0300 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.6680 1.5770 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2020 1.2590 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 1.2060 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 0.6930 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.1630 -2.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -1.2290 -3.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 -0.4620 -4.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -2.9940 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -2.2010 -4.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -2.6380 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -6.2550 -1.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -5.0060 -3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 -4.9880 1.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -8.2280 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 -6.9480 4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 -8.2130 6.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -10.6690 6.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -11.8660 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 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 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END