PUBCHEM-ZINC04096212 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.1170 1.4410 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 -0.0890 -0.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5440 -0.3810 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 -0.6340 -0.3340 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2350 -0.1540 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -2.1220 -0.1090 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0480 -2.5660 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -2.6650 1.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3390 -2.4550 1.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -1.9920 1.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0730 -2.2620 2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -0.5610 1.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -2.4220 0.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 -4.1030 0.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -4.3830 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -2.5380 0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -3.5210 -1.2230 P 0 0 0 0 0 0 0 0 0 0 0 0 -2.2550 -4.6350 -0.9750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -0.3910 -1.6760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -1.2480 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 1.9030 0.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 1.2740 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 1.8890 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 1.7990 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 -2.3900 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7320 -3.8900 -0.9980 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.9990 -2.5590 -2.3850 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 19 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 M CHG 1 26 -1 M CHG 1 27 -1 M END