PUBCHEM-ZINC05389550 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 1 0 0 0 0 0999 V2000 -0.4620 1.0360 -0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -0.4930 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -0.9060 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4060 -0.6470 2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -1.4710 2.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -1.0620 1.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 -1.0260 0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 -0.5380 -1.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 0.2880 1.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6730 -2.1090 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -1.0710 3.6910 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.5050 4.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 0.4150 5.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 0.7410 6.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 1.6390 7.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 1.7030 8.6240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 0.9440 9.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 0.0890 8.3820 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3720 -0.0440 7.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -0.8240 6.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9510 -1.8110 6.1880 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8680 -1.4270 5.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 -2.1780 7.6700 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8400 -1.3760 8.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -3.4500 7.8800 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5680 -3.2760 8.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -3.7010 6.5010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3080 -3.2560 6.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 -3.0510 5.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -5.2020 6.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 -5.4170 4.9900 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -4.5520 8.2550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5680 -2.4530 7.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 2.4390 6.8270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -1.0420 -1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5590 1.3990 -0.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 1.3300 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9010 1.4660 0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -1.9690 1.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 -0.3330 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6340 0.4100 2.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -2.5310 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2570 -1.3070 3.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -0.8780 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4490 1.0440 1.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 0.5790 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 0.2020 2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 -2.1240 2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -1.8470 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2350 -3.0940 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -1.7490 3.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 1.0280 10.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -5.6090 6.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -5.7010 7.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -6.3490 4.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -5.3770 8.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 -2.6890 8.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 2.3840 5.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 3.0550 7.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -0.6530 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -2.1310 -1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -0.7300 -2.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 11 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 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 44 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 9 47 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 10 50 1 0 0 0 0 11 12 1 0 0 0 0 11 51 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 52 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 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 33 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 32 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 34 58 1 0 0 0 0 34 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 M END