IBS-ZINC01752847 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.9570 0.7260 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 -0.7160 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -1.4950 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -2.8200 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3050 -2.7690 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -1.4870 -1.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -3.8060 -1.5030 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2410 -4.7800 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -3.4950 -2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 -3.1820 -1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -3.6670 -0.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -5.0170 0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7310 -4.9490 1.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 -3.6250 1.9740 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9450 -3.2940 2.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -2.8390 0.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -1.3650 0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -6.0150 2.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -7.2040 2.3410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -5.4860 3.8590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -6.4520 4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -6.2650 -0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5790 -2.4960 -2.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -3.4530 -3.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -3.1950 -4.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 -3.7450 -3.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -3.7660 -4.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -3.9680 -2.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 -4.3220 -2.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0700 -3.0840 -2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0160 -4.2400 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3820 -2.2220 -2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0060 1.1530 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 0.8950 -1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3090 1.2630 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -1.1460 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 -3.7010 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -0.9890 1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1670 -1.0930 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -0.8540 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 -7.1650 4.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -5.9220 5.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -6.9700 4.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4650 -6.9700 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7150 -6.7470 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -6.0620 -1.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -3.2370 -5.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 -4.9360 -3.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -4.9400 -1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 -2.5160 -1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8700 -2.4240 -3.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8220 -3.6590 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4860 -5.1940 -1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0870 -4.4240 -1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0510 -1.7330 -3.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 -1.5620 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4230 -2.5390 -2.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -3.4520 -2.3940 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.6710 -4.0380 -3.2290 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 9 10 1 0 0 0 0 9 24 2 0 0 0 0 10 11 1 0 0 0 0 10 23 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 58 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 58 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END