PUBCHEM-ZINC05873689 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 -1.3670 1.9340 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 0.4360 -0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -0.2810 -0.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2370 -1.6330 -0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -2.3920 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -3.7660 -0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -4.3860 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -3.6320 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -2.2580 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -5.8850 0.0540 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9990 -6.3040 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -6.4540 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 -6.1290 -2.3790 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4120 -5.6810 -3.3480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 -6.3070 -2.4250 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2340 -6.2500 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -7.7600 1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -8.4840 0.6190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 -8.2660 2.6080 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3020 -7.4800 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -8.0190 4.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -6.1420 3.5260 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 -5.4530 2.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -4.2410 2.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 2.4810 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 2.1220 -1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 2.2670 0.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 0.1030 -1.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 0.2490 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3620 -1.9080 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2170 -4.3570 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -4.1180 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -1.6700 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -6.0200 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -7.5370 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -5.9400 1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -9.2280 2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7080 -5.6540 4.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 23 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 M CHG 1 13 1 M CHG 1 15 -1 M END