CHEMBRIDGE-ZINC04810496 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.0420 1.3700 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -0.0070 0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2440 -0.6890 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 0.0180 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 1.3940 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 2.0820 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 3.5580 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 4.1550 0.1970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 4.2440 -0.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 5.7090 -0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 6.2360 -1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4730 7.7660 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6360 8.2640 0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 7.7370 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 6.2070 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -2.0830 -0.0720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -2.7620 -0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -2.1630 -0.9740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1430 -4.2660 -0.4120 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1600 -4.6510 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -4.8440 -1.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -4.5350 -1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 -4.1650 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0130 -3.9830 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -4.6870 0.8320 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7970 -5.7670 0.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.2820 2.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -3.7140 1.9780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 1.8990 0.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 -0.5580 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.5150 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3230 1.9420 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1720 3.7670 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 6.0680 -0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 5.8770 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3700 5.8800 -2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2940 8.1410 -1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 8.1250 -1.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5830 7.9060 0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6270 9.3540 0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 8.0920 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 8.0960 0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 5.8320 1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 5.8480 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0410 -2.5640 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1060 -4.4080 -2.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -5.9250 -1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 -4.6260 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -3.9740 -0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -2.9200 0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -4.4070 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -4.5520 3.2850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 -4.2720 4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 16 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 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 27 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 52 53 1 0 0 0 0 M END