IFLAB-ZINC04519013 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 -1.1900 1.2380 0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.2000 0.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -1.1310 1.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -2.4630 1.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 -2.8630 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 -1.9440 -0.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -0.6130 -0.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 -4.5640 -0.2210 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8890 -4.6400 -1.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -5.0090 0.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 -5.4150 -0.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7820 -5.3020 0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -6.9010 -0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -7.6600 0.4350 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -7.9380 1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -7.5730 2.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -8.7880 2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -9.2130 2.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -9.0230 3.8070 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 -9.8360 4.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 -11.3220 4.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5650 -12.1750 5.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -14.3730 5.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -14.3380 5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -4.7410 -1.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3130 -3.9050 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -3.5820 -2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8500 -4.2520 -3.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9460 -4.9620 -2.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 1.7890 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 1.7040 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9110 1.3270 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -0.8210 2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -3.1710 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -2.2500 -1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4530 0.1030 -1.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -7.3760 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -7.0400 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -8.0180 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6650 -8.5940 3.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -9.5490 4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -9.6050 5.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -11.5940 4.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -11.5110 3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 -11.8300 5.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -12.1560 6.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 -14.3910 6.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6620 -13.8650 5.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 -15.3850 5.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -13.8310 4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -14.3340 6.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -15.3610 4.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7610 -3.5600 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 -2.9430 -2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -4.3240 -4.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 -13.6160 4.9760 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7700 -13.6050 3.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 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 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 56 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 56 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 24 56 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END