PUBCHEM-ZINC06883348 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 53 0 0 1 0 0 0 0 0999 V2000 -0.7210 1.6090 -0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 0.2360 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7710 -0.5540 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -0.5730 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9730 0.0770 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8710 -0.8310 -1.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 -0.4530 -1.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0310 -1.3970 -2.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 -1.1340 -2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9340 0.0770 -2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 1.0250 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7190 0.7600 -1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2820 0.2060 -2.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8880 1.4120 -1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3960 1.3900 -2.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9870 0.4400 -2.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0080 2.5550 -1.6270 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4470 2.8470 -1.6990 C 0 0 3 0 0 0 0 0 0 0 0 0 12.8610 2.3730 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1850 2.4130 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3070 0.8920 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1670 0.2190 -1.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9060 0.6190 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6700 4.3900 -1.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6680 5.0730 -1.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 2.2440 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 1.5210 -1.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5200 2.1330 -0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 0.3860 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1800 -0.7410 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 -1.5220 0.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5230 -0.0080 0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -1.5740 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2550 -0.7410 -2.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 1.0140 -1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 0.2660 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 -2.3440 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0450 -1.8780 -2.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4580 1.9810 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 1.5260 -0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4760 2.2670 -2.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7370 1.5400 -0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4770 3.3470 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1960 2.8420 -0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6680 2.8510 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3100 0.4390 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2760 -0.8510 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7210 0.3110 -2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1700 0.6580 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2840 1.0570 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9720 -0.4580 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9130 1.0410 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7920 4.7640 -2.2220 O 0 5 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 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 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 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 2 0 0 0 0 24 53 1 0 0 0 0 M CHG 1 53 -1 M END