PUBCHEM-ZINC05596581 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.5440 1.9490 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 0.4510 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -0.3300 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3560 -1.8370 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -2.5930 -0.0400 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -2.8460 -1.3750 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3490 -1.8360 -1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 -3.5710 -1.3350 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.4270 -4.6600 -1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3510 -3.2180 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5260 -3.6580 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 -2.9570 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6570 -2.7550 2.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -3.2240 -2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2700 -2.1260 -3.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2820 -3.6190 -2.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -3.1960 -3.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -3.8980 -4.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 -5.0380 -4.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 -5.4800 -2.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 -4.7720 -1.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -5.7790 -4.9530 N 0 3 0 0 0 0 0 0 0 0 0 0 0.4470 -5.3110 -6.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 -6.8310 -4.5420 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4080 2.4870 0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 2.3050 -0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1230 2.2020 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 0.2350 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 0.1320 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2200 -0.1050 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1870 -0.0010 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7470 -2.0710 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -2.1570 0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5480 -2.1390 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3240 -3.7230 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0720 -3.4270 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 -4.7390 1.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6510 -2.3220 -3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1740 -3.5460 -5.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -6.3670 -2.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -5.1220 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3720 -4.0960 -2.7740 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 2 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M CHG 1 42 -1 M END