PUBCHEM-ZINC05688448 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 28 0 0 1 0 0 0 0 0999 V2000 -0.4200 -2.6770 -1.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3890 -2.4840 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 -0.7040 -0.0110 P 0 0 3 0 0 0 0 0 0 0 0 0 -2.6200 -0.5180 1.1190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 0.0260 0.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 1.4100 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 -0.0640 -1.3460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -0.3810 -1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6210 0.4030 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 0.0780 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2810 -1.0280 -1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2880 -1.8100 -2.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9590 -1.4870 -2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7040 -1.3740 -2.1660 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.5800 -0.6850 -1.6750 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9980 -2.3470 -2.8360 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2450 -3.7410 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -2.2430 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5250 -2.1820 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -2.9780 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 -2.9180 0.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 1.5840 1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 1.6920 0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 2.0100 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3610 1.2660 -0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7260 0.6880 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5510 -2.6740 -3.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 -2.0960 -2.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 17 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 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 25 1 0 0 0 0 10 11 1 0 0 0 0 10 26 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 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END