IFLAB-ZINC02698724 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 68 0 0 0 0 0 0 0 0999 V2000 0.4560 1.3130 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -0.1760 0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 -0.9070 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -2.2950 1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.9550 0.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 -2.2460 -0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5770 -0.8570 -0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 -4.7150 0.5450 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -5.2360 -0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -5.0820 1.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7450 -5.1980 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9520 -5.8860 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -6.0730 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4560 -6.5340 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6160 -6.3570 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5550 -5.6950 0.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 -5.2350 1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1250 -5.3950 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8390 -4.9260 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7110 -4.2440 2.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0900 -2.8330 2.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -2.0700 3.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -4.2070 4.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -5.0140 3.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -2.0450 5.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -2.6810 7.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 -3.1390 7.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -3.7630 8.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7340 -3.9370 9.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8950 -3.4770 8.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8260 -2.8450 7.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7810 -5.5350 1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 1.5560 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.7830 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 1.7460 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -0.3980 1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -2.8490 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -2.7460 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -0.3050 -1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -6.1320 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5190 -7.0570 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5590 -6.7450 -0.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 -4.7510 2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 -2.3330 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1480 -2.7640 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2340 -1.9190 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -1.0990 3.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -4.7350 5.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -4.0200 4.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3400 -5.3040 3.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8720 -5.9480 3.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -1.0640 5.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -1.8940 5.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -3.0190 7.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 -4.1120 9.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -4.4270 10.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8560 -3.6060 9.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 -2.4840 7.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8720 -6.3790 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7370 -4.6060 2.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6830 -5.4880 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1610 -6.3060 -1.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 -2.8430 4.6640 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1670 -3.0090 4.9770 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 40 1 0 0 0 0 12 62 2 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 13 62 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 63 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 63 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 25 63 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END