IBS-ZINC04074016 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 75 0 0 1 0 0 0 0 0999 V2000 -0.0900 1.3980 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -0.1320 -0.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4450 -0.5010 -0.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -0.6050 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -2.1350 1.1760 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2080 -2.4910 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -2.6720 1.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2100 -2.3210 2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -4.2030 1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -4.6600 2.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -4.1510 2.5400 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5100 -2.6240 2.3660 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5490 -2.3090 2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 -2.0820 3.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -3.0300 4.7540 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4800 -2.5860 5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 -4.3380 4.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1940 -5.4890 4.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -5.6130 6.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -4.3130 6.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -3.3030 5.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 -4.6010 4.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -5.6770 4.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4280 -3.5200 3.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 -4.8720 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -2.1850 -0.0270 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4920 -0.6690 -0.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2450 -0.1960 -1.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 -0.7350 -1.2720 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1820 -0.3670 -0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6450 -2.2650 -1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8970 -2.7240 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 -0.2930 -2.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -0.1860 1.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7620 -2.6880 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 1.7810 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6260 1.7350 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 1.7670 0.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -0.2220 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -0.2340 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 -4.6070 1.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -4.5510 0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5010 -4.2740 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -5.7500 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -1.0580 3.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -2.1410 3.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -5.2920 4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -6.4190 4.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0140 -6.4390 6.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 -5.8020 6.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 -4.5200 7.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 -3.8900 7.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -2.3710 6.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -3.7190 5.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 -2.5990 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1470 -3.3500 4.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9540 -3.8290 2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -4.7920 0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 -4.4140 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -5.9230 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 0.8940 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -0.5640 -2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 -2.6490 -1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 -2.6330 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -3.8140 0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3990 -2.3650 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2970 -0.5980 -2.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2090 0.7780 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -3.7780 -1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -2.3410 -2.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 -2.3040 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 26 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 27 1 0 0 0 0 26 32 1 0 0 0 0 26 35 1 0 0 0 0 27 28 1 0 0 0 0 27 34 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 28 62 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 33 1 0 0 0 0 31 32 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 33 67 1 0 0 0 0 34 68 1 0 0 0 0 35 69 1 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 M END