PUBCHEM-ZINC05125408 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.6820 -0.4390 -1.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 0.2320 -0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -0.3030 -0.2340 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9490 1.3380 -0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 0.9760 0.5440 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.1210 0.3580 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 0.2320 0.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3720 2.2240 1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6300 2.7240 1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 3.8690 2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6380 4.5140 2.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3800 4.0150 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2480 2.8670 1.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7800 5.7410 3.7170 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.8880 6.1820 3.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 6.3100 4.1390 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4160 -1.8080 -0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -2.4330 1.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -3.8140 1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 -4.5680 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -3.9420 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 -2.5620 -1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 0.0170 -1.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8050 -1.5020 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.3090 -2.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 0.0140 0.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 1.3100 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 1.4840 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 2.2190 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5080 2.2190 1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7450 4.2590 2.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5020 4.5200 2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 2.4750 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -1.8440 1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2320 -4.3020 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -5.6460 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -4.5320 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5620 -2.0730 -2.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 0.1190 -1.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 0.3320 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 7 1 0 0 0 0 3 17 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 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 30 1 0 0 0 0 10 11 1 0 0 0 0 10 31 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 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END