PUBCHEM-ZINC05852715 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2930 -0.7750 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 -1.8320 -0.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 -2.6310 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 -2.4140 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5090 -3.2300 -0.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 -4.2420 -1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4850 -4.9530 -1.4290 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 -4.4800 -2.1000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4440 -5.2140 -2.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 -3.7000 -2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -3.9130 -2.7070 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6950 -2.9970 0.3890 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.4910 -2.2100 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8850 -2.5920 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9610 -3.6660 -0.2090 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.9460 -4.4500 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5030 -4.2180 1.1650 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.8380 -3.5650 1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0600 -4.2080 1.0710 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0230 -5.6410 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6870 -6.0820 2.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2920 -3.0610 -0.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.7660 -2.6000 -1.0220 N 0 3 0 0 0 0 0 0 0 0 0 0 -10.2400 -2.1380 -1.9300 N 0 5 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -0.5310 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -1.1950 1.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 -0.1070 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4250 -1.6040 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2490 -1.6030 -0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6000 -2.6160 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1060 -5.6540 1.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5670 -6.3070 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9870 -6.9780 2.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 35 1 0 0 0 0 22 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 2 0 0 0 0 25 26 2 0 0 0 0 M CHG 1 25 1 M CHG 1 26 -1 M END