IFLAB-ZINC04139553 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 0.1320 -2.5920 -2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 -1.5390 -1.8790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -1.1240 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -1.5700 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5480 -2.2770 1.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -1.8440 0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -1.8680 3.4990 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5690 -2.9510 3.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -1.6770 4.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 -2.6100 5.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 -2.1150 6.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8430 -0.8200 6.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -0.2120 4.9550 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 -1.2300 3.8210 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5110 -1.5790 3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 0.3000 3.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3150 -1.6660 5.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 -3.0560 5.3220 S 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 -3.2970 6.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 -4.0670 4.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8090 -2.5230 4.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5360 -1.5700 5.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7650 -1.1340 4.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2670 -1.6440 3.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5350 -2.6210 3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3040 -3.0610 3.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6040 -1.1980 3.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -2.6450 -1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -2.3470 -3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -3.5830 -2.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -1.4550 -2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -0.5590 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 -0.0680 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7050 -1.2880 -1.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0430 -2.5990 0.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5470 -0.9240 1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -2.1870 2.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -3.3400 1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0190 -2.5110 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -0.8080 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -3.6050 5.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8700 -2.6780 7.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -0.2010 6.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3440 0.7420 4.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 0.6420 3.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 0.7130 2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8890 -1.2860 5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1580 -1.1640 6.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3320 -0.3940 5.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9220 -3.0440 2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7510 -3.8180 2.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3940 -1.8360 3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6410 -1.2470 2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8050 -0.1600 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 -1.9380 -0.5620 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0650 -2.9190 -0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7580 -1.4650 2.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 31 1 0 0 0 0 2 32 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 55 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 57 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 57 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 6 55 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 14 1 0 0 0 0 7 57 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 43 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 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 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 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 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 55 1 M END