IBS-ZINC05342980 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 0 0 0 0 0 0999 V2000 0.1050 1.4640 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 0.0040 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -0.8250 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -0.6080 2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -1.6750 3.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -2.9740 2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -3.2070 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -2.1310 0.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -2.0350 -0.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -0.7860 -1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 -0.2870 -2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -0.2420 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1330 0.0790 -5.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 0.4580 -6.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4400 1.9110 -6.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 2.0670 -6.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 1.6410 -4.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -4.0510 3.7670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3940 -3.8970 5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -2.8570 5.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -5.0160 6.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -4.6140 7.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -5.5160 8.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -5.1910 9.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -6.1060 10.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -7.3510 10.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2110 -7.6770 9.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2460 -6.7630 8.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7280 -8.2520 11.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -9.5150 11.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 1.7380 -0.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4800 1.8800 -0.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 1.8600 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 0.3970 2.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -1.5040 4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2430 -4.2150 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -0.9600 -3.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8000 0.7130 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 0.4300 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -1.2420 -3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -0.9600 -5.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 0.7250 -4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 0.3500 -7.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1610 -0.1960 -7.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 2.5700 -6.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 2.1720 -7.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 3.1090 -6.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 1.4380 -6.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 2.2800 -4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 1.7370 -3.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4510 -4.9080 3.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -5.9000 5.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 -5.2500 6.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -4.2210 9.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 -5.8530 11.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -8.6460 8.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -7.0180 7.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -10.0100 10.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9250 -9.3600 10.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -10.1380 11.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 0.2440 -4.5330 N 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 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 12 61 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 13 42 1 0 0 0 0 13 61 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 49 1 0 0 0 0 17 50 1 0 0 0 0 17 61 1 0 0 0 0 18 19 1 0 0 0 0 18 51 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 M END