PUBCHEM-ZINC05649357 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 49 0 0 1 0 0 0 0 0999 V2000 1.1520 2.0160 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 0.5090 0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -0.1350 -1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 -1.6670 -1.0710 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6860 -2.0280 -0.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5670 -2.3560 -2.3750 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5950 -2.0210 -2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -3.9000 -2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 -4.4090 -1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -1.9760 -3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2640 -2.3920 -4.8480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 -2.4540 -6.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -2.1680 -6.0640 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -2.9150 -7.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -2.9900 -8.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -3.4540 -9.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -1.9880 -0.8910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6960 -2.5740 0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.8210 1.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 -2.8840 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7260 -3.4250 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2190 -3.7440 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7440 -3.7010 0.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 2.2660 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 2.4800 -0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 2.4550 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6200 0.0810 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 0.2990 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5150 0.2950 -1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 0.1290 -1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -4.2810 -2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8830 -4.3490 -3.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 -4.1580 -0.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6490 -5.5000 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5750 -3.9950 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 -2.4150 -3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -0.8920 -3.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 -2.6270 -4.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1610 -2.2160 -7.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7480 -3.9000 -6.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -3.6790 -8.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.0070 -8.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7140 -3.5010 -10.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1590 -2.7650 -9.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -4.4510 -9.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -1.9620 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -3.6180 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -4.3430 1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 -2.6960 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 -4.0200 2.5560 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 17 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 50 1 0 0 0 0 M CHG 1 50 -1 M END