IFLAB-ZINC04337077 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 4.9150 0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 5.5250 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 4.8650 -1.6780 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 7.0140 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 7.6750 -0.0270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5370 7.6240 -1.7760 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 9.0840 -1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 9.5160 -2.9180 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6880 10.6010 -2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0280 9.0720 -4.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0520 8.1960 -4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3500 8.6280 -4.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8750 8.9060 -2.7510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5540 9.4740 -4.8450 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 9.3030 -6.2510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1750 10.7020 -4.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3980 8.2660 -4.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 7.1230 -5.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 6.1750 -4.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 6.3710 -3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 7.5160 -2.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 8.4660 -3.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5550 5.1820 -2.8640 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 3.0090 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3960 5.4430 0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 7.0970 -2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 9.4160 -0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 9.5310 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1310 8.3800 -5.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8300 7.1470 -4.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7700 9.5240 -4.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0780 7.8170 -4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7180 6.9700 -5.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 5.2820 -5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 7.6700 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 9.3610 -2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 50 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 50 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 50 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 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 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 M END