PUBCHEM-ZINC05594520 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 1 0 0 0 0 0999 V2000 5.3870 -0.7180 -1.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 -0.0410 -2.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2290 1.3400 -2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 2.0660 -1.6680 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5310 1.4030 -0.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 0.0080 -0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6430 2.1190 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 3.4500 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9610 4.1250 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0170 5.4760 0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 6.1750 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 5.5250 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5550 4.1660 0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9000 7.6210 1.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 8.0480 2.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 8.3700 0.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 9.8310 0.5040 C 0 0 3 0 0 0 0 0 0 0 0 0 3.8660 10.2640 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 10.2450 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 9.9000 2.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 10.3310 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 10.7810 2.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8760 10.3910 -0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 9.5330 -1.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 -1.8040 -1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9550 -0.5770 -3.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 1.9250 -3.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8300 -0.5150 -0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 1.6150 0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8930 3.6020 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9760 5.9840 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6750 6.0680 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 3.6800 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 7.9430 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 11.3260 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 9.7630 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 8.8160 2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 10.3630 3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 10.1700 4.7470 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1840 11.6080 -1.0970 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 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 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 M CHG 1 39 -1 M CHG 1 40 -1 M END