NCID-ZINC04962403 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 -0.7790 1.4170 0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 0.0620 0.0480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -0.5220 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -1.8570 0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -2.5760 1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.9700 2.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 -0.6270 3.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 0.0920 2.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -2.7390 4.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 -2.7040 3.6850 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 -3.4400 5.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4400 -3.7780 5.2330 C 0 0 3 0 0 0 0 0 0 0 0 0 6.6420 -4.5580 4.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7950 -4.3040 6.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0420 -3.5610 7.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6950 -5.6700 6.7470 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8610 -6.3990 8.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4880 -7.8900 7.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2720 -8.2560 6.6630 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2870 -2.6250 4.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5330 -2.7720 4.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0240 -3.8520 4.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2510 -1.4490 4.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5770 -1.6100 3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3620 -0.3100 3.3670 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7570 0.5200 2.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6550 -0.4310 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6390 -0.0840 3.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 2.0720 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 1.7270 -0.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 1.5220 1.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 -2.3410 -0.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6560 -3.6120 1.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -0.1270 4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 1.1270 2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -2.3140 5.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -3.7800 4.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7230 -2.7250 6.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3620 -4.3490 5.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 -6.2890 5.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9080 -6.3080 8.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2310 -5.9240 8.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9460 -1.7050 5.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5950 -0.7650 3.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4140 -1.0280 5.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1910 -2.3830 3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3700 -1.9810 2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4380 -8.5440 8.9360 O 0 5 0 0 0 0 0 0 0 0 0 0 12.5750 -0.7950 1.3280 O 0 5 0 0 0 0 0 0 0 0 0 0 11.8250 0.1000 4.7540 N 0 3 0 0 0 0 0 0 0 0 0 0 12.8710 0.1980 4.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7670 -0.6230 5.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4950 1.0150 5.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 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 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 23 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 27 1 0 0 0 0 25 50 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 50 53 1 0 0 0 0 M CHG 1 48 -1 M CHG 1 49 -1 M CHG 1 50 1 M END