NCID-ZINC04707593 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 64 0 0 0 0 0 0 0 0999 V2000 0.3720 2.4050 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 1.4220 0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 0.4650 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 0.5000 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 1.4750 -0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 2.4300 -0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -0.5360 0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -1.6690 0.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7170 -0.0830 0.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8970 -0.8540 0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9090 -2.2350 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1220 -2.9240 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3570 -2.2530 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3500 -0.8550 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1210 -0.1750 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5700 -0.1640 0.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7910 -0.8490 0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8290 -2.2340 0.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5990 -2.9150 0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6120 -4.2810 1.0820 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0380 -2.9410 0.9510 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2460 -3.6830 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5310 -4.2480 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6750 -5.6290 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9460 -6.2030 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1060 -5.4110 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9510 -4.0270 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6810 -3.4540 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4420 -6.0090 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3630 -5.4920 1.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6330 -6.0590 1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0200 -7.1570 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1110 -7.6770 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8390 -7.1120 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2750 -7.7160 0.8680 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3300 0.0890 0.5470 S 0 0 0 0 0 0 0 0 0 0 0 0 13.0220 -0.3040 1.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9090 -0.3840 -0.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4070 3.1490 -0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 1.3990 1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -0.3020 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3900 1.4930 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 3.1880 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 0.9080 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9940 -2.8120 0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0980 -4.0030 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1300 0.9040 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5730 0.9160 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5540 -4.5420 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7950 -6.2650 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0210 -7.2780 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8200 -3.3750 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5830 -2.3770 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0920 -4.6430 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 20.3140 -5.6300 2.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3850 -8.5290 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1630 -7.5390 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9330 -7.3410 1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 21.5570 -8.5100 0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8740 1.4770 0.5270 O 0 5 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 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 19 2 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 20 49 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 56 1 0 0 0 0 34 57 1 0 0 0 0 35 58 1 0 0 0 0 35 59 1 0 0 0 0 36 37 2 0 0 0 0 36 38 2 0 0 0 0 36 60 1 0 0 0 0 M CHG 1 60 -1 M END