IFLAB-ZINC04079613 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -0.7010 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -2.1450 -0.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 -0.7040 -2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -1.0960 -3.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 -0.4730 -2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -0.8650 -3.9980 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8580 -0.5160 -3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7910 -0.6820 -4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1390 -0.3870 -4.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4820 0.0330 -3.3090 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 0.1720 -2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 -0.0960 -2.5640 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8170 -0.6290 -5.6880 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8640 -1.0620 -6.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7020 -1.0810 -6.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.1940 -0.4750 -5.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6590 -0.0440 -7.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0150 0.1080 -7.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9120 -0.1710 -6.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4480 -0.6020 -5.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0930 -0.7590 -4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2470 -0.0220 -6.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.1140 -0.3260 -5.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -0.5230 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 -0.0180 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9580 -2.8280 -1.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4980 -2.3120 -0.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 -2.3230 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -1.1140 -1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 0.5710 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8900 0.5160 -1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9600 0.1740 -7.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3770 0.4440 -8.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1470 -0.8180 -4.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7320 -1.1000 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9780 -1.3680 -5.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8760 0.3220 -4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1490 -0.1650 -5.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 18 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M END