PUBCHEM-ZINC00253667 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 38 0 0 1 0 0 0 0 0999 V2000 0.0490 1.5430 -0.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 0.0480 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 -0.5440 1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 -1.9370 1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -2.7730 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -2.2010 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.8090 -1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -0.2700 -2.4290 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2430 -0.5800 -3.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 0.4600 -2.8850 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3630 -4.1770 0.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -4.9920 1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -4.5930 2.5930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -6.4990 1.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4710 -6.6080 0.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -7.3390 2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -7.5810 3.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -7.3810 2.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9020 -6.9600 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -7.0640 0.3500 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4540 -8.1330 0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -6.5160 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 -5.6310 -1.4650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 1.9420 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8020 1.8460 -0.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 2.0040 0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 0.0720 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6140 -2.3400 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -2.8390 -1.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 -4.6850 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -8.3160 2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -6.8590 2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -7.9110 4.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -7.5420 3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6960 -7.6000 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -5.9350 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -6.9930 -1.6110 O 0 5 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 2 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 20 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 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 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 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M CHG 1 37 -1 M END