NCID-ZINC01698169 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -0.2080 1.5120 -0.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 0.0020 -0.5100 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3670 -0.4590 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4470 -0.6120 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -1.0590 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4370 -1.6130 -1.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -1.7120 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -1.2570 1.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 -0.6970 0.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 -1.4120 2.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -2.0070 2.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6390 -2.4320 1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1640 -2.3040 0.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8450 -3.0020 1.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -1.0460 3.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -0.2850 0.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -0.3100 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7460 -0.6060 1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1390 -0.6540 2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9420 -0.4210 0.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3500 -0.1040 -0.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9560 -0.0540 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4140 -0.4950 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9480 -0.1550 2.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0650 -0.9900 0.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5190 -1.0450 -0.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0070 -1.1540 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0270 0.2060 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8440 1.5020 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3820 2.7660 -0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6800 2.6750 -2.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8700 -2.2550 -1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8910 -2.6670 -1.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 1.9830 -0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 1.7490 -1.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.9860 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -0.9910 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2560 -3.1250 2.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3640 -3.3230 0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3620 -2.1250 3.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -0.4780 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -0.8060 2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 -0.8870 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9560 0.1260 -1.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 0.1960 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 -1.4070 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0930 0.0850 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5110 0.2980 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7790 1.6850 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3340 1.4020 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4590 3.7740 -0.0540 O 0 5 0 0 0 0 0 0 0 0 0 0 10.0520 -2.6930 -1.0330 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 16 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 16 17 1 0 0 0 0 16 41 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 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 32 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 29 50 1 0 0 0 0 30 31 2 0 0 0 0 30 51 1 0 0 0 0 32 33 2 0 0 0 0 32 52 1 0 0 0 0 M CHG 1 51 -1 M CHG 1 52 -1 M END