NCID-ZINC05028517 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 69 0 0 1 0 0 0 0 0999 V2000 -0.0020 1.5020 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 0.1210 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 -0.5490 -0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 0.1620 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 1.5440 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 2.2140 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 -0.5680 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 -0.8450 -1.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 -1.4970 -1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 -1.8260 -0.7980 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 -1.7850 -3.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9850 -2.4950 -3.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2280 -2.6920 -4.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4220 -2.2790 -5.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3400 -3.3260 -5.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5760 -3.5170 -6.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8780 -4.2470 -6.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5440 -4.5750 -5.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3040 -4.5350 -7.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5990 -4.1970 -9.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4450 -4.7450 -10.3920 C 0 0 3 0 0 0 0 0 0 0 0 0 11.0870 -3.9650 -10.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2930 -5.8550 -9.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5550 -5.2360 -8.3180 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3850 -4.5300 -8.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8400 -6.3190 -7.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9510 -6.7340 -6.5980 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0840 -6.8270 -7.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 13.3610 -7.8810 -6.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8140 -8.2710 -6.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5440 -7.7250 -7.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2990 -9.2250 -5.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5910 -9.6010 -5.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6240 -8.7950 -5.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9360 -9.1800 -5.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2200 -10.3660 -6.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1920 -11.1700 -6.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8780 -10.7930 -6.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6270 -10.7750 -6.2840 N 0 3 0 0 0 0 0 0 0 0 0 0 21.5340 -10.0670 -5.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 20.8780 -11.8200 -6.8580 O 0 5 0 0 0 0 0 0 0 0 0 0 9.6060 -5.2940 -11.4100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 2.0260 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -0.4350 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2510 -1.6280 -0.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 2.1000 -0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 3.2930 -0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4940 0.0500 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 -1.5060 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1860 -1.5220 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8000 -1.9100 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9380 -3.4660 -2.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9840 -3.6550 -4.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7610 -4.1020 -6.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6230 -2.5460 -7.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6130 -4.6610 -9.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5020 -3.1150 -9.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7280 -6.7840 -9.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2280 -6.0140 -10.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7950 -6.4960 -7.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1380 -7.5130 -5.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7390 -8.7500 -6.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4030 -7.8690 -4.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7410 -8.5530 -5.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4160 -12.0960 -7.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0750 -11.4240 -6.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0020 -4.6530 -11.8100 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 43 1 0 0 0 0 2 3 2 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 45 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 46 1 0 0 0 0 6 47 1 0 0 0 0 7 8 1 0 0 0 0 7 48 1 0 0 0 0 7 49 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 50 1 0 0 0 0 12 13 1 0 0 0 0 12 51 1 0 0 0 0 12 52 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 53 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 16 55 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 42 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 63 1 0 0 0 0 35 36 1 0 0 0 0 35 64 1 0 0 0 0 36 37 2 0 0 0 0 36 39 1 0 0 0 0 37 38 1 0 0 0 0 37 65 1 0 0 0 0 38 66 1 0 0 0 0 39 40 2 0 0 0 0 39 41 1 0 0 0 0 42 67 1 0 0 0 0 M CHG 1 39 1 M CHG 1 41 -1 M END