IFLAB-ZINC04942294 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 1.4930 1.3360 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -0.1350 -0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -0.2400 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -1.7100 -0.0900 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4300 -2.2760 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -1.8240 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8760 -2.3040 0.9000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2680 -2.2470 1.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -3.5700 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -4.3170 0.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 -4.1110 2.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -5.4830 2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -5.9850 3.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -5.1250 4.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3260 -3.7510 4.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 -3.2510 3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -5.6640 6.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -5.1900 7.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -4.2710 7.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -3.8160 6.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -3.9770 8.8580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -4.5120 9.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.2560 11.4790 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3360 -5.5410 8.9410 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -3.0720 9.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 1.4100 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.7590 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1790 1.8850 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 -0.6840 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -0.5590 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 0.3090 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 0.1840 -1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -1.6510 1.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -6.1460 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -7.0450 3.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -3.0860 5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -2.1910 3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -6.4370 6.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6200 -3.6490 9.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -2.5380 10.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -2.3550 8.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -1.3920 -1.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0090 -1.4850 -1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 42 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 24 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 42 43 1 0 0 0 0 M END