PUBCHEM-ZINC05381374 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 0.0210 1.5890 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.0590 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.4290 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -0.4440 1.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -0.6560 2.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9700 -1.3090 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -1.3090 3.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0980 -2.2450 3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -0.3600 3.8560 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4710 -0.2000 3.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 0.9780 4.2820 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9780 1.6790 4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 1.5430 3.1270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9990 1.7330 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 0.5980 2.7600 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 2.8500 3.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 3.4370 2.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 0.7780 5.4220 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5110 -0.9300 4.9510 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -1.5780 4.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -2.6030 5.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -3.3030 5.2060 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -2.8800 6.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 1.9460 0.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 1.9730 -0.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 1.9370 0.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -0.2980 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7430 -0.0720 -1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -1.5190 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.0450 -2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0280 2.6450 4.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 3.5390 3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 4.2700 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 1.5860 5.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -0.3810 5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -1.0180 4.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -3.5710 6.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -3.3210 7.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -1.9460 6.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 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 15 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 M END