IFLAB-ZINC01514814 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3750 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 1.2080 -0.6830 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0160 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3980 1.3960 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 3.5640 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 4.1630 0.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3340 4.2480 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3220 5.6350 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4380 6.4190 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 7.8480 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 8.0940 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 6.5890 0.0200 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 9.5960 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9040 10.2290 -0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 9.1570 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7690 5.8920 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 5.4740 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -2.4440 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -2.8380 0.5080 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.8590 0.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -2.9260 -1.6070 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -3.1330 -2.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4630 -4.5390 -2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -4.7130 -3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -4.5610 -2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -3.1600 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -0.5200 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3300 1.9400 -0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1780 3.7700 -0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 9.8470 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 9.9300 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 10.3690 -1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 11.1720 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 9.3740 1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 9.1060 -0.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -2.3920 -3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 -3.0380 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -4.6710 -3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 -5.2810 -2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -3.9550 -4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -5.7040 -4.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -4.7080 -3.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 -5.3030 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 -3.0830 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -2.4210 -3.1010 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 12 13 2 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 3 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END