IFLAB-ZINC00956719 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.3360 1.1630 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 0.4200 -0.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -0.2250 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1080 -0.1270 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7940 0.6250 1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 1.2650 1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -0.8160 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5640 -0.0990 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8760 -0.8510 0.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4550 -0.4030 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7980 -2.3000 -0.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 -2.8720 -0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -4.5570 -0.6390 S 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 -2.1710 -0.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6370 -0.6410 1.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6800 0.2660 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3790 0.4600 2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0350 -0.2550 3.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9880 -1.1650 3.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 -1.3520 2.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7210 -0.0660 4.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 1.2910 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7030 1.7210 1.4840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 2.1440 -0.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 3.5070 -0.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 4.0450 0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5180 5.4000 1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 6.1750 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 5.5740 -1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 4.2790 -1.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 1.6700 0.3250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 0.3440 -1.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -0.8060 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 0.7050 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 1.8470 2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6050 -2.8330 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -2.6450 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 0.8230 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1940 1.1690 2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 -1.7230 4.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4700 -2.0560 2.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3550 0.6270 5.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2760 1.8090 -1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1500 3.4130 1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8820 5.8460 1.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 7.2360 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9460 6.1720 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 M END