NCID-ZINC04096831 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 1 0 0 0 0 0999 V2000 0.2370 1.8410 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2070 0.3160 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -0.3620 1.0770 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3050 0.3490 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -1.3180 1.6860 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -1.8290 0.9710 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7360 -2.6230 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -0.2590 0.2450 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -2.2930 2.3510 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7240 -3.3690 2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -1.8940 2.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -1.9210 3.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6360 -1.4830 2.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 -1.8710 4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2050 -2.9390 4.6050 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3870 -0.8340 4.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9940 -1.1360 5.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0180 -0.0710 6.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5670 -0.2690 7.6070 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7720 -0.3120 8.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5890 0.8300 8.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6700 0.2440 8.3720 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -0.9320 0.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4120 -2.1690 0.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -0.0940 -1.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 2.2200 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 2.3260 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 2.1690 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8600 -0.5980 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9040 0.1500 4.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1700 -0.8140 3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4640 -2.1260 5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1960 -1.1800 6.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5440 0.9170 6.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8410 -0.0600 5.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5650 0.2540 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -1.1800 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1290 0.3490 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2500 2.0280 7.9130 O 0 5 0 0 0 0 0 0 0 0 0 0 -7.3160 -1.5830 7.7030 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.9340 -2.2420 8.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5370 -2.0230 6.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2390 -1.2070 8.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3130 -0.0710 0.4340 O 0 5 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 40 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 M CHG 1 39 -1 M CHG 1 40 1 M CHG 1 44 -1 M END