PUBCHEM-ZINC05159556 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 1 0 0 0 0 0999 V2000 0.1220 1.3120 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6810 1.7090 -0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 1.8800 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7280 2.2080 -1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 2.5010 -2.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 2.2840 -2.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 1.8920 -1.5020 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4990 2.9660 -4.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 3.6020 -4.8260 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2900 2.2020 -1.6790 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.5770 3.1830 -2.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0140 1.0510 -2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3700 0.9240 -1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0750 1.2340 -0.2110 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.7070 0.3680 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2730 1.9020 0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0470 3.1380 0.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1730 -0.2160 -2.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5090 -1.1280 -1.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4730 1.3300 -3.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3180 2.5240 -4.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7300 1.7500 0.7810 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2120 0.3420 1.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 1.2200 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 2.0660 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 2.4160 -3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 2.1170 -4.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 3.7270 -3.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 3.8510 -5.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1160 1.6300 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8140 -0.0740 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 1.7320 -1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9300 2.2060 -0.3150 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.1560 1.9670 0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3280 3.1150 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2650 1.1790 0.7900 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.1850 -0.2110 -3.2270 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.0490 0.3900 -4.4340 O 0 5 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 33 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 33 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 M CHG 1 7 1 M CHG 1 22 -1 M CHG 1 33 1 M CHG 1 36 -1 M CHG 1 37 -1 M CHG 1 38 -1 M END