PUBCHEM-ZINC00303589 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.6170 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -2.0060 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3070 -2.6310 2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -1.8680 3.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -0.4700 3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 0.1450 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5680 -2.5320 4.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -3.7430 4.3280 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 -1.7080 5.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 -2.5980 6.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0130 -3.0360 6.3410 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1880 -3.8040 7.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0260 -3.8110 8.0650 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2050 -3.0610 7.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4310 -4.5240 7.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4640 -5.3030 8.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6220 -5.9700 9.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7480 -5.8650 8.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7210 -5.0920 7.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5660 -4.4260 6.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9870 -6.5820 8.8540 N 0 3 0 0 0 0 0 0 0 0 0 0 10.0140 -7.2630 9.8640 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9800 -6.4910 8.1550 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -2.5930 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -3.7090 2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 0.1230 3.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1700 1.2230 1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -1.0670 4.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 -1.0920 5.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5860 -5.3860 9.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6490 -6.5750 10.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6030 -5.0120 6.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5440 -3.8260 6.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 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 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 23 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 23 24 2 0 0 0 0 23 25 1 0 0 0 0 M CHG 1 23 1 M CHG 1 25 -1 M END