PUBCHEM-ZINC05932683 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 -0.2490 -0.0520 2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -0.9830 1.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -1.6480 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -2.5200 -0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -2.8230 -0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -3.6770 -1.8740 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 -2.0780 -0.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -1.1780 0.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3550 -0.4950 0.5500 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -0.6810 -0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6050 0.0260 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7910 -0.0890 -0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7000 -0.9940 -1.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 -1.7200 -2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -1.5680 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 -2.2760 -1.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7330 -1.2170 -2.6680 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.9430 0.6610 -0.4500 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9170 1.5350 0.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1930 2.2930 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2370 1.4870 1.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1330 0.5590 1.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4320 -0.6930 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0230 -0.6110 -0.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1430 0.5830 -1.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6590 -3.1400 -0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1440 -3.7200 0.6830 O 0 5 0 0 0 0 0 0 0 0 0 0 0.6640 0.0330 2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 0.9540 1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -0.3850 2.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 -1.4010 1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 0.7030 0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5430 -2.4030 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -2.9770 -2.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6110 0.9510 1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 2.3010 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8720 3.0930 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6440 2.8230 0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7530 0.9230 2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8980 2.2090 2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9380 0.2270 1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6250 1.1120 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5700 -0.9510 1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1280 -1.5380 0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5200 -1.5500 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9270 -0.5740 -1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7370 1.4970 -1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8830 0.5590 -2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -2.9520 -1.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 16 34 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 2 0 0 0 0 M CHG 1 27 -1 M END