NCID-ZINC05067028 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 71 0 0 1 0 0 0 0 0999 V2000 -0.3070 0.3450 0.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -0.6180 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -0.9250 -0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 -0.2560 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 0.6820 1.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 0.9900 1.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -0.6380 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9160 0.5570 0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1570 0.3950 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0270 1.4740 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6890 2.7390 0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4900 2.9230 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6220 1.8440 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1690 -1.9020 1.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 -1.7590 2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5030 -2.8600 3.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 -4.1390 2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -4.3180 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1740 -3.2160 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2280 -1.0070 -1.6340 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9820 -1.5360 -1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2050 -2.6770 -2.6290 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4140 -3.4310 -2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5440 -3.3370 -2.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6290 -2.8490 -2.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4010 -4.4680 -1.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5010 -5.2390 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9750 -6.3940 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7110 -6.5260 -0.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2430 -2.2240 -4.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7510 -3.0060 -5.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2570 -4.1170 -4.8780 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9230 -2.3630 -6.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 -3.1390 -7.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4290 -2.5750 -8.8760 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2620 -1.4940 -8.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 -3.2760 -9.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3780 -3.7320 -10.8520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 0.5800 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 -1.1470 -0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -1.7110 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 1.1860 2.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 1.7260 2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4860 -0.5790 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9740 1.3170 1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3650 3.5770 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 3.9030 -0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7040 2.0210 -0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2360 -0.7750 3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6170 -2.7150 4.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7510 -4.9970 3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 -5.3190 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 -3.4270 -0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6020 -0.6680 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 -1.8660 -0.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4920 -4.8720 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1000 -5.6380 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1220 -4.5600 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6710 -1.3280 -4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5480 -1.3340 -6.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9970 -2.3220 -6.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 -4.1990 -7.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1070 -3.1180 -7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8530 -7.0500 0.5560 O 0 5 0 0 0 0 0 0 0 0 0 0 3.3310 -3.2890 -9.8420 O 0 5 0 0 0 0 0 0 0 0 0 0 6.8730 -2.8060 -9.2770 N 0 3 0 0 0 0 0 0 0 0 0 0 6.6880 -3.3000 -10.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3890 -3.4820 -8.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4060 -1.9570 -9.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 20 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 11 12 2 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 49 1 0 0 0 0 16 17 1 0 0 0 0 16 50 1 0 0 0 0 17 18 2 0 0 0 0 17 51 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 30 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 1 0 0 0 0 27 58 1 0 0 0 0 28 29 2 0 0 0 0 28 64 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 34 63 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 66 1 0 0 0 0 37 38 2 0 0 0 0 37 65 1 0 0 0 0 66 67 1 0 0 0 0 66 68 1 0 0 0 0 66 69 1 0 0 0 0 M CHG 1 64 -1 M CHG 1 65 -1 M CHG 1 66 1 M END