PUBCHEM-ZINC03874327 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 48 0 0 1 0 0 0 0 0999 V2000 -0.1810 1.0650 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -0.4570 -0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -0.8280 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -1.0140 -0.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -2.5400 -0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -3.0170 -0.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 -4.3760 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 -5.2380 -0.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7460 -4.6830 -0.0040 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3000 -3.9050 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1120 -4.6670 1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6040 -4.9190 1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8200 -4.9680 3.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5130 -3.8550 1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -5.9590 -0.6180 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3130 -6.1140 -1.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3380 -5.1870 -2.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6570 -7.5480 -2.3980 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.6270 -7.8120 -1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5930 -8.5860 -2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 -9.0890 -0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0620 -8.2140 0.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8300 -7.5240 -3.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 1.4750 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8330 1.3500 -1.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.5400 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2710 -0.8720 -1.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -1.9100 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -0.3640 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4600 -0.4940 1.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -0.6200 0.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -0.6490 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1610 -2.9590 -1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -2.9460 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7190 -2.3460 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5140 -5.4290 2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 -3.7040 1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8940 -5.8950 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5580 -4.0140 3.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8670 -5.1860 3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2070 -5.7520 3.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2200 -2.8490 1.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4830 -3.8910 0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5550 -4.0140 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0430 -6.8400 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 -9.4390 -2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -8.1710 -2.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8440 -6.5760 -4.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4210 -10.3040 -0.4620 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 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 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 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 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 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 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 2 0 0 0 0 21 49 1 0 0 0 0 23 48 1 0 0 0 0 M CHG 1 49 -1 M END