IBS-ZINC04039295 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.2010 1.5880 -0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 0.1140 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -0.6630 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 -1.9740 0.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -3.1810 1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 -4.3410 0.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -4.3120 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -3.1500 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -1.9140 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 -0.6720 -1.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -0.3570 2.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 0.0860 2.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 0.3250 2.2850 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4560 1.0420 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 1.0140 3.3160 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 1.1180 4.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 1.6400 5.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 0.4930 4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 0.3610 5.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 1.5780 3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5940 2.9200 2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9460 2.8890 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7730 5.0430 1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -0.9400 1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3730 -1.1920 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 -2.3840 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3750 -3.2920 0.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2790 -3.0850 2.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -1.9250 2.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0540 -0.5200 3.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 1.9760 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 1.8870 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 2.0580 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -3.1360 2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -5.3000 1.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -5.2630 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3260 -3.1300 -2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 1.7260 4.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 0.8470 2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 2.7980 1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 3.5950 2.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5330 2.7670 0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1550 1.9230 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8630 3.4840 1.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 5.5530 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3590 5.0330 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7560 5.5210 1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0130 -0.4790 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 -2.6030 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 -4.2380 0.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6450 -1.8140 3.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -0.2840 4.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9360 3.6170 2.2360 N 0 3 0 0 0 0 0 0 0 0 0 0 6.3220 3.6740 3.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 11 12 2 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 24 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 53 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 53 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 53 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 51 1 0 0 0 0 30 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END