IBS-ZINC05164049 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 50 0 0 1 0 0 0 0 0999 V2000 -2.8290 -0.4420 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -1.0530 -0.3500 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6030 -1.9450 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -0.0330 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -0.6300 0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 -1.0170 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5700 -1.9940 -1.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7480 -1.4280 -1.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 -2.4650 -2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -3.8150 -2.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 -4.2420 -3.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4090 -3.3500 -4.7260 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0970 -2.0730 -4.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -1.6320 -3.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 -1.1760 -5.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 -1.6440 -6.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -0.4620 -7.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9690 -0.9500 -9.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0770 0.2060 -10.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3690 -1.4640 -8.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -5.5770 -3.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 -4.7740 -1.5300 N 0 3 0 0 0 0 0 0 0 0 0 0 0.1050 -5.3460 -1.5270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -4.9920 -0.6450 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.6910 0.4500 -1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4300 -1.1680 -1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -0.1730 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 0.8740 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 0.2040 1.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3850 0.1070 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 -1.5160 1.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5310 -0.1280 -1.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 -1.4560 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3410 -2.1650 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -0.5380 -2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -0.2380 -5.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 -2.0910 -6.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4310 -2.3880 -7.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 -0.0150 -7.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 0.2820 -7.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -1.7570 -9.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6630 1.0130 -9.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5680 -0.1420 -10.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 0.5720 -10.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8590 -1.8120 -9.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9540 -0.6570 -8.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2920 -2.2880 -7.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -6.2210 -3.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8980 -5.8670 -4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 22 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 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END