IFLAB-ZINC04193661 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 0.3710 1.4270 0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -0.0990 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -0.6680 1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -2.1860 1.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -2.1120 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -0.5920 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -4.1230 0.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2160 -4.5510 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2210 -4.7040 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -6.0840 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2010 -6.6320 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1310 -5.7810 3.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 -4.4500 2.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 -3.9480 1.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5270 -4.6420 -1.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -5.4640 -1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -5.7820 -3.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6160 -5.0960 -3.2980 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -4.3860 -1.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -3.7040 -1.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -3.2570 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8650 -3.2370 -3.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9960 -2.6920 -1.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4060 -6.6060 -4.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -7.3940 -3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -6.5120 -2.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -5.9740 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3750 1.8480 0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 1.8310 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 1.7770 1.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -0.4590 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2630 -0.2440 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -0.3760 2.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9780 -2.5600 2.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -2.6530 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -2.5980 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -2.3990 -1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.2520 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 -0.1550 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -6.7510 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2260 -7.6970 2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 -6.1560 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 -2.8710 1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -3.5150 -0.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2530 -3.3590 -0.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8730 -2.5880 -2.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7190 -1.7110 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -5.9380 -4.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 -7.3030 -4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -7.8020 -4.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -8.2470 -2.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -5.6710 -3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -7.0800 -2.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4070 -6.7760 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -5.1800 -0.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 -2.6050 0.4500 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8190 -2.1330 0.3110 H 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 3 1 0 0 0 0 2 6 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 56 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 56 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 7 56 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 40 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 42 1 0 0 0 0 13 14 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 19 2 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END