NCID-ZINC04576930 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.7590 1.0810 -0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -0.2000 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.3720 1.2040 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1740 -0.7930 1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -1.0760 -0.3170 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3430 -0.3180 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -0.2100 -1.3840 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2840 -2.2740 -0.9900 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9940 -2.7100 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -3.4070 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -3.3820 -2.6970 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0910 -1.8390 -2.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3370 -1.2670 -2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9470 -1.0320 -1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9220 -0.9670 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 -2.0910 -3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 -3.2310 -4.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 -4.2790 -5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3920 -4.2000 -4.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9820 -3.0760 -4.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1850 -2.0270 -3.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 0.8200 1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 0.5300 2.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -1.4090 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 1.9840 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 1.0930 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4620 1.1650 0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -2.0340 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -0.7620 -4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4990 -0.0370 -3.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1240 -3.3150 -4.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5390 -5.1580 -5.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0120 -5.0190 -5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0630 -3.0170 -4.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6600 -1.1620 -3.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 -1.3460 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -2.3660 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6480 -1.4480 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9100 -1.4090 0.9540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6020 -1.2520 1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -4.2690 -0.5860 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8790 1.8980 2.0200 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 3 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 41 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 41 -1 M CHG 1 42 -1 M END