PUBCHEM-ZINC06761379 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.2280 1.5070 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2550 0.0220 0.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -0.5020 1.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.6850 -0.2750 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -2.1540 -0.2640 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1210 -2.5310 0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -2.6960 -1.7050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2400 -2.1420 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -2.5430 -2.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5670 -2.9540 -1.5470 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4600 -2.3330 -0.2400 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 -2.6640 0.4860 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1810 -3.7540 0.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -2.1120 1.9260 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5670 -1.0260 1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 -2.7200 2.6150 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6110 -3.8160 2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7810 -2.2750 4.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0420 -2.7300 4.5710 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6410 -2.6330 3.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 -2.3210 1.9600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6900 -2.3950 0.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.3820 2.7020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -1.7230 2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -2.4030 -2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 -2.3240 -1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7140 -1.1850 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -4.5190 -1.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -5.1370 -1.6020 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -4.0500 -1.7180 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -4.6480 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 1.9180 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 1.7440 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 1.9640 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -0.1820 -1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -1.4820 -2.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 -3.1080 -3.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9860 -2.6810 4.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 -1.1830 4.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -1.3900 -2.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0740 -3.0060 -3.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5010 -3.2670 -1.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6050 -1.2030 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3470 -0.2190 -1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7940 -4.9960 -1.0790 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 4 35 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 30 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 28 1 0 0 0 0 11 12 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 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 29 2 0 0 0 0 28 45 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 45 -1 M END