IBS-ZINC04729767 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 1.5030 2.4190 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 0.9230 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6780 0.2380 -1.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -1.0900 -1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9510 -1.6620 -0.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -1.8680 -2.5830 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4540 -1.4980 -3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 -3.3560 -2.3910 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0580 -3.6960 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 -4.0670 -3.4630 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1060 -4.7240 -4.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1560 -2.6260 -3.7290 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8900 -2.3380 -4.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 -1.7180 -2.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 -0.9000 -2.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6490 -2.5230 -3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2880 -3.5000 -3.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 -1.3460 -3.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7070 -1.3210 -3.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2300 0.0940 -3.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1970 -4.5090 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0640 -5.8300 -1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5190 -6.2360 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1080 -5.3210 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2430 -4.0010 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 -3.5960 -1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -3.5560 -2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -3.6970 -1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -3.8800 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -3.9220 -2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -3.7800 -3.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 -3.5920 -3.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 2.5680 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 2.8210 -1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 2.9330 0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7120 0.5200 0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 0.7740 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9410 -1.6200 -2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1790 -2.0130 -4.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7580 0.7860 -3.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3100 0.1130 -3.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9960 0.3930 -4.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -6.5440 -2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 -7.2670 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4630 -5.6380 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 -3.2870 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9000 -2.5660 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -3.6650 -0.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4210 -3.9920 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -4.0660 -2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -3.8130 -4.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -3.4770 -4.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -4.1270 -3.4910 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 -5.0820 -3.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 53 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 10 53 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 2 0 0 0 0 16 18 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 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 31 2 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 53 54 1 0 0 0 0 M END