PUBCHEM-ZINC05680485 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 1.6770 1.3970 2.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 0.4300 2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -1.0010 2.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 -1.1520 3.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0470 -2.0880 3.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 2.8840 2.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3140 3.1350 3.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 2.9080 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1070 4.3170 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9820 5.2510 2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1530 5.6640 2.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 6.4670 4.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 6.7950 4.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 6.3880 3.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 5.6680 2.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 5.2940 1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7210 3.9270 1.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 3.6010 0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 4.3860 -0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 3.9380 -1.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 5.5940 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6200 6.3590 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 6.3210 1.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2510 5.8820 -0.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 6.7320 4.5130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 5.8010 5.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 7.5810 5.7570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4820 7.2220 6.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 6.9460 4.7330 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4430 6.9500 4.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1770 0.4510 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4610 1.5160 4.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 2.2050 2.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5050 0.4310 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 0.8030 3.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 -1.6990 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -1.2670 1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5510 2.3200 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 2.4340 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5870 4.7440 0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1550 4.2300 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 5.3420 2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4160 2.5890 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2290 7.2160 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1060 7.3100 2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5120 5.2760 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 6.6700 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 4.7760 5.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9490 6.0590 5.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 5.8610 6.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 7.4640 7.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 7.8210 6.8990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7110 6.1510 6.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3360 7.4300 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 5.9340 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1650 7.5320 4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 1.4330 2.2010 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5620 1.1200 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 57 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 57 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 6 57 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 42 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 23 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END