IFLAB-ZINC04105787 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 2.9560 7.3860 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 8.4300 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6150 8.6560 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 7.8370 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 6.7920 1.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8050 6.5630 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 5.5020 0.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0850 4.2590 0.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 3.5290 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 4.3500 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 5.5390 -0.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 3.7100 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 2.2320 0.3880 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 1.1170 -0.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 2.1120 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 3.8040 1.2060 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5470 2.4930 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8840 1.7240 0.5190 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 1.9830 1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 0.4720 1.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0440 -0.0460 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2550 -1.5320 2.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4460 -2.0500 3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1680 -1.8620 4.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9570 -0.3760 4.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 0.1420 4.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4990 9.6770 0.1840 F 0 0 0 0 0 0 0 0 0 0 0 0 2.3640 7.2120 -1.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 9.0700 -1.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0560 8.0150 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4480 6.1520 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 4.3880 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 3.4180 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8870 1.4150 -0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 1.8110 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8110 4.4310 1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6310 2.4770 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5610 2.1970 3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9420 -0.0210 2.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 0.2580 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9400 0.5100 2.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3590 -2.0880 2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4530 -1.6660 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5960 -3.1080 2.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3420 -1.4940 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2720 -2.4180 4.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0160 -2.2310 5.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7590 -0.2420 5.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8530 0.1800 4.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 1.2010 4.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 -0.4140 4.3570 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 16 1 0 0 0 0 9 10 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 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 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 M END