PUBCHEM-ZINC00969920 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 0.4470 0.1950 2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 0.0450 1.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -0.0010 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3710 0.0980 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7550 0.2510 1.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 0.2970 2.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 0.0780 -0.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5970 0.5920 -0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4860 -0.0190 -1.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8080 0.4300 -1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2780 1.5040 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4010 2.1170 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 1.6650 0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 2.0320 -0.9690 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6280 1.5910 -1.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6040 0.5760 -2.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8460 2.5530 -1.7690 C 0 0 3 0 0 0 0 0 0 0 0 0 10.4550 3.5140 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9030 2.0630 -2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7930 0.9800 -2.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8740 0.6980 -0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1360 1.4730 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5460 2.7810 -0.4110 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3840 3.4690 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7600 3.4770 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5400 3.6990 0.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 0.2310 3.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -0.0320 1.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -0.1060 -0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 0.3040 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1240 0.4100 3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -0.3980 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -0.8690 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4440 -0.0830 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7360 2.9610 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 2.1920 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8060 2.8570 -0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4220 1.7030 -3.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5410 2.9050 -3.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3720 0.4000 -2.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5100 -0.1170 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3500 0.8360 0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8380 1.6910 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4140 3.7530 1.7480 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 27 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 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 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 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 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 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 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 44 1 0 0 0 0 M CHG 1 44 -1 M END