NCID-ZINC04984106 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -0.4960 1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -1.6700 1.4750 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1790 -2.4200 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 -2.3320 2.8170 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5430 -3.1660 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -2.8140 2.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 -2.3380 1.6840 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2700 -2.0950 1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -1.0890 1.3230 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6390 -0.3080 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -0.5160 0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -3.3310 0.6080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -4.3060 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 -5.0100 -0.6050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6110 -4.5340 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0680 -3.4540 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1680 -2.8100 -0.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8250 -3.1770 -1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4360 -4.1860 -2.6430 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3430 -4.8840 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -5.9420 -3.1500 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -1.3180 3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.0040 5.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -1.9840 5.8990 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8700 -1.9650 6.5660 N 0 5 0 0 0 0 0 0 0 0 0 0 0.6990 -0.5060 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4040 -4.4690 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 -2.6320 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -6.4510 -2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -6.1740 -3.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -0.8500 3.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -0.5550 3.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -0.1420 -1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 -1.5960 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -0.1380 -2.1420 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 2 13 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 24 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 24 25 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 25 26 2 0 0 0 0 26 27 2 0 0 0 0 28 38 1 0 0 0 0 28 39 1 0 0 0 0 28 40 1 0 0 0 0 M CHG 1 26 1 M CHG 1 27 -1 M END