NCID-ZINC04544788 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 46 0 0 1 0 0 0 0 0999 V2000 -0.5130 0.9780 0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -0.3510 0.2920 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5890 -0.2100 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 -0.9340 1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -1.9070 2.0300 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 -0.2680 1.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -0.6540 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3810 0.3430 2.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4580 1.1990 1.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3030 0.1740 3.3550 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4900 1.0180 3.5310 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1670 2.0660 3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5370 0.7770 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8900 -0.6020 2.3400 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0590 -1.1070 2.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0320 0.6950 4.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5110 -0.1880 5.6180 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0760 1.4810 5.3440 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7850 1.3450 6.6270 C 0 0 3 0 0 0 0 0 0 0 0 0 8.0650 1.0310 7.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9520 0.3460 6.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5010 -1.1070 6.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6240 -2.1460 6.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7870 -1.7390 6.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4090 2.7150 7.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5140 3.5410 6.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -1.3330 0.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 -1.3070 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8410 -0.4870 -1.9090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 1.7150 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 1.3970 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 0.8550 1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 0.5250 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -0.6680 3.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -1.6550 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1810 -0.5480 4.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1560 1.0870 1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4550 1.3420 2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4350 2.2610 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6040 0.6180 5.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5730 0.4180 7.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7660 -1.3460 7.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0140 -1.2450 5.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -2.0710 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5690 -2.1410 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2410 -3.3120 6.7560 O 0 5 0 0 0 0 0 0 0 0 0 0 9.6960 2.8510 8.2620 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 M CHG 1 46 -1 M CHG 1 47 -1 M END