PUBCHEM-ZINC05273563 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 53 0 0 1 0 0 0 0 0999 V2000 -0.6880 -2.1900 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -1.0170 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -1.4740 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -0.5210 -0.4490 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6440 0.3210 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -0.0830 0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4870 -0.8460 1.1760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 1.1570 1.2160 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 1.5870 2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7990 2.9100 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6340 3.3310 3.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0550 2.4360 4.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 1.1170 4.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8100 0.6890 3.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9500 2.8900 5.3660 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.3150 4.0510 5.4090 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3210 2.1030 6.2180 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.4740 -1.6040 -1.1750 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1880 -1.8210 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -1.1190 -3.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8750 -2.9350 -3.2210 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.9240 -2.9780 -2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1960 -4.2650 -2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 -5.3930 -3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6250 -5.8060 -4.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -6.8410 -5.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3530 -7.4620 -4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6840 -7.0490 -3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -6.0170 -2.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2660 -2.6640 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -1.8260 1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -2.9170 0.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -0.2080 0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -2.2830 -1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -0.6380 -1.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -1.8270 -0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 1.7520 0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4710 3.6100 1.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9590 4.3600 3.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 0.4210 4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 -0.3420 3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1220 -2.1650 -0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -4.2540 -3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1860 -4.4080 -1.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 -5.3210 -5.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0640 -7.1630 -6.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8990 -8.2690 -5.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4890 -7.5340 -2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2400 -5.6970 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 -2.6400 -4.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 -2.6850 -4.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2920 -3.3840 -5.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 51 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 27 28 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END