PUBCHEM-ZINC04760645 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 1 0 0 0 0 0999 V2000 0.3050 1.4410 -0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -0.0200 0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1760 -0.1200 0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -0.6760 1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -1.5870 0.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -0.2380 2.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 0.4220 2.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 -0.3970 4.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5820 -0.5710 4.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -0.8220 4.9490 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -0.3920 4.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -0.4340 3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6550 -0.4570 3.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -0.7870 -1.1960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -0.7230 -2.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -0.0150 -2.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -1.6080 -3.5000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0300 -1.4330 -3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -3.0820 -3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -4.0150 -4.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -4.2180 -4.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -5.0550 -5.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -5.7000 -6.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 -5.5140 -6.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -4.6780 -5.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 1.5340 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 1.9010 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 2.0300 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4220 3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 0.4970 2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 -1.3990 5.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 0.6310 5.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 -1.0670 5.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -1.3910 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2270 -3.4020 -2.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -3.1980 -2.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -3.7380 -4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -5.2130 -6.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8710 -6.3560 -7.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4910 -6.0300 -6.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -4.5580 -4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -1.1920 -4.7650 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5910 -1.8420 -5.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -0.2540 -5.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -1.1170 -4.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 42 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 25 2 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 42 45 1 0 0 0 0 M CHG 1 42 1 M END