IBS-ZINC02131078 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -5.0930 -2.2760 2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1880 -3.4880 2.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8590 -4.7600 2.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7600 -3.3000 2.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1860 -4.2240 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -2.9590 0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 -1.7450 0.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -2.2430 2.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5670 -2.3470 4.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 -3.4020 4.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -1.2000 4.6080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 0.1350 4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 1.1900 5.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 2.2690 4.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 3.2420 5.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 3.1460 6.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 2.0810 7.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 1.0980 6.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.0360 6.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -1.3500 5.9050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9880 -1.8810 6.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -2.2060 5.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 -2.1930 4.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 -2.1220 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0640 -2.4170 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6510 -1.3610 2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1110 -3.6070 3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 -4.6850 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2110 -5.6320 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7930 -4.9500 2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 -1.4280 2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 0.3390 3.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7610 0.1820 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 2.3590 3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 4.0770 5.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 3.9080 7.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 2.0260 8.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 0.2700 6.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 -0.2030 7.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 -3.9100 -0.2540 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2090 -2.9920 6.7820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -3.5220 6.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 40 1 0 0 0 0 8 9 1 0 0 0 0 8 31 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 20 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 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 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 41 42 1 0 0 0 0 M CHG 1 40 -1 M END