IBS-ZINC04980731 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 0.4270 -1.7730 -0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -1.9210 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -0.4930 2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -0.1540 2.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 -0.2400 1.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 1.2710 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0570 1.6310 1.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2280 3.0720 0.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 3.8980 2.1620 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5730 3.6550 2.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3570 5.3700 1.6890 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2980 5.2300 0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1920 3.7930 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0720 3.4040 -1.3420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2970 6.1420 -0.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1250 6.0610 2.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 5.4740 2.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 7.4770 2.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1280 8.3650 2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1710 9.6870 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 10.1250 3.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3730 9.2450 4.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3290 7.9230 3.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4660 9.5460 5.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 10.8760 5.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7010 3.5920 2.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6940 3.5100 4.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8670 3.2230 4.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0610 3.0210 4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0850 3.1120 2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9150 3.4010 2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -1.4400 -1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -2.7360 -1.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3630 -1.0550 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -2.2750 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -2.6240 1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 0.2950 3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -1.4500 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2260 0.7990 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -0.9240 2.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3460 -0.0620 3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -0.6720 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9330 -0.7200 2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 1.7070 0.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 1.7240 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 1.2230 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4160 1.2050 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 5.9050 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 8.0690 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8810 10.3840 2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 11.1610 3.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 7.2400 4.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 11.1130 6.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 11.5970 4.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 10.9480 6.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 3.6640 4.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8500 3.1560 6.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9730 2.7960 4.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0170 2.9570 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9630 3.4650 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9240 -0.5770 1.3860 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4000 0.1370 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 61 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 61 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 61 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 15 2 0 0 0 0 13 14 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 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 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 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END