NCID-ZINC04995221 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 0.3020 1.7270 0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3430 0.1990 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -0.3900 1.3440 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3200 -1.4310 1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -0.3110 2.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2710 -0.4890 2.1610 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7610 -1.3300 2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -0.5250 0.3270 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 0.8810 2.7530 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2310 0.8490 3.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1200 0.8850 3.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 1.6960 3.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0190 1.8800 1.7680 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 3.0220 2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 3.2240 3.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0420 4.0500 1.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 5.2420 1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1160 6.2850 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7470 7.4770 1.5800 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0480 7.8650 2.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0710 8.5560 0.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2010 8.6830 0.1710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 0.4040 1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 0.8540 2.7400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -0.2960 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 2.1220 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3450 2.1000 -0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 2.0490 1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 1.7190 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1760 4.3880 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 3.6060 0.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 4.9040 2.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 5.6850 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 6.6230 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 5.8410 0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3830 7.7980 2.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 0.0710 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9920 -1.3850 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 0.0750 -2.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1040 9.3770 0.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9810 7.0450 2.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6460 6.6800 1.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 0.6100 0.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9940 1.1250 0.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3590 10.0540 -0.5000 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 8 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 23 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 41 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 36 41 1 0 0 0 0 40 45 1 0 0 0 0 41 42 1 0 0 0 0 43 44 1 0 0 0 0 M END