NCID-ZINC01621543 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7210 1.5710 -1.1790 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0900 1.7830 -1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 2.2440 -2.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 2.4820 -3.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 2.8870 -4.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 2.2570 -3.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 1.8160 -2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 1.6290 -2.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 2.5030 -4.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0720 2.3610 -1.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1890 1.9810 -0.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0150 1.6410 -0.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 2.6600 -2.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 1.9520 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6870 0.5530 0.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9940 0.5240 1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2010 -0.8540 2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7020 -1.1630 3.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8930 -2.4270 3.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5820 -3.3810 3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0810 -3.0720 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8950 -1.8070 1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7850 -4.7350 3.7100 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.3440 -5.0070 4.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3920 -5.5760 3.0720 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 1.4370 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 3.5330 -4.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 1.8240 -4.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 2.3340 -5.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4250 2.6800 0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3080 2.2000 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7370 -0.1740 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 0.3060 1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9430 1.2510 2.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8260 0.7710 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1640 -0.4170 3.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5020 -2.6680 4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6190 -3.8180 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2880 -1.5640 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END