IBS-ZINC05051196 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 50 0 0 0 0 0 0 0 0999 V2000 0.1340 1.6180 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 0.3490 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -0.3320 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3570 0.2460 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 1.5370 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 2.2090 1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 2.1100 0.8310 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 1.4680 0.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 0.1340 -0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -0.4160 -0.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8920 -0.2540 -0.5630 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7410 0.7630 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0850 1.7570 0.3320 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2020 0.7420 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8720 1.9100 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2360 1.8850 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9420 0.7040 -0.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2820 -0.4580 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9190 -0.4430 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2790 0.6850 -1.0280 F 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 -1.5200 -1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2910 -1.3460 -2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4560 -0.9510 -3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4830 -0.7910 -4.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3400 -1.0250 -5.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1660 -1.4230 -4.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1490 -1.5880 -3.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1940 -1.5890 -5.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8910 -1.6850 -7.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1040 -0.9410 -6.7850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 2.1390 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -0.0990 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 -1.3140 -0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4460 3.1920 1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 2.8300 -0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7560 2.7870 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8370 -1.3760 -0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4060 -1.3480 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2570 -1.8200 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 -2.2890 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3480 -0.7670 -2.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3940 -0.4820 -5.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -1.9000 -2.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -2.7250 -7.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3050 -1.2300 -7.8080 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 10 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 M END