PUBCHEM-ZINC06363524 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 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 0.0200 -0.6140 1.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.6690 -1.1640 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -2.1190 -1.0960 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4800 -2.4490 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -2.6120 -1.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9820 -2.2480 -1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -4.1430 -1.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7780 -4.6280 -2.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -4.2200 -2.2960 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7010 -2.7000 -2.3170 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7530 -2.4160 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -2.1850 -3.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 -1.0460 -4.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -0.4980 -3.4710 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.4510 -5.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2590 -4.8210 -3.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -6.1380 -3.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -5.9440 -1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3330 -4.7690 -1.2030 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 -5.7680 -1.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -7.1600 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -2.1110 0.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2530 -2.2980 0.2430 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3530 -2.4840 0.3820 N 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 -4.4980 -1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -4.5060 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -0.8500 -6.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 0.6330 -5.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -0.7050 -5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -4.2430 -3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -4.8910 -4.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0090 -6.6670 -1.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 -5.5960 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 -4.9140 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4810 -7.2970 -0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 -6.9990 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -8.0480 -1.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 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