IBS-ZINC04137409 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -1.1710 0.5600 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 0.8150 2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 2.8660 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9290 3.5790 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 5.0290 0.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 5.8000 -0.6220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1370 5.5750 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1530 7.2970 -0.3400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9260 7.2140 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 5.8100 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1130 5.4620 2.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1710 8.1370 1.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9870 7.9760 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2010 7.7980 -1.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 8.7990 -2.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 9.5900 -2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 10.3230 -3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 10.2720 -4.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2200 9.4950 -4.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8310 8.7680 -3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 9.3580 -5.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2150 10.0620 -7.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 5.4100 -2.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 5.4290 -2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 5.1230 -4.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 4.7940 -4.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 4.7780 -4.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0140 5.0880 -2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4190 4.3790 -4.9760 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -0.4680 0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 0.6160 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 0.9340 -0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 0.8340 2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -0.2090 2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3470 1.4120 3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 2.8990 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3130 3.3370 2.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 3.2020 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 3.3770 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 7.8240 -0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 9.6770 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 10.9440 -2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 10.8580 -5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 8.1640 -3.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 9.8410 -7.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2540 11.1440 -6.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 9.7240 -7.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 5.6930 -2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 5.1490 -4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 4.5640 -5.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9760 5.0970 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 1.4080 1.4320 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5570 1.3790 1.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 52 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 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 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END