IFLAB-ZINC04305258 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.6880 1.6580 0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8270 0.1690 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -0.5990 1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2880 -1.9960 1.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -2.6410 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -1.8640 -1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -0.4720 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -2.5590 -2.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -1.8190 -3.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -2.8330 -4.6990 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9190 -3.6160 -4.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -2.1700 -5.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -4.2160 -7.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -5.2210 -8.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7120 -4.5200 -9.6060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -3.4500 -9.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 -2.4330 -8.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -4.8780 -10.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 -4.5980 -12.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -4.9700 -13.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -5.6190 -13.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2460 -5.8720 -11.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0140 -3.4960 -5.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -3.7470 -4.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 -4.1410 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6870 -2.7670 2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 1.9180 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 2.1520 -0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 2.0550 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3770 -0.1020 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 0.1470 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -1.1160 -3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -1.2910 -3.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -1.2590 -6.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -1.9360 -5.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -4.7110 -6.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4100 -3.7180 -7.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7800 -6.0030 -8.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -5.7290 -8.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -2.8980 -10.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -3.8860 -9.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -1.8940 -8.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 -1.7190 -8.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -4.1210 -12.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -4.7570 -14.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3850 -5.9240 -13.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -6.3830 -11.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -4.4150 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -4.5420 -1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -4.6410 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -3.4570 2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -3.3260 2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -2.1010 3.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -3.1300 -7.1230 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4520 -3.5890 -6.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -5.5210 -10.6370 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 23 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 54 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 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 56 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END