PUBCHEM-ZINC05848518 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 1.6190 6.6190 -1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 8.1320 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 5.7970 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 6.1120 1.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6470 4.8600 2.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 5.2010 3.4510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 5.1320 4.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 4.9770 5.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 4.9010 6.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 4.9790 7.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 5.1380 7.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 5.2240 5.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 5.4610 5.8530 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2210 4.1240 6.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8850 5.6910 4.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 5.5600 3.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 5.8190 1.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6040 6.1860 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5660 6.2790 2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2070 6.0350 3.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9590 6.4430 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4980 5.3510 -0.6180 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.8620 7.4490 -0.1690 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.8800 6.7950 -0.7710 F 0 0 0 0 0 0 0 0 0 0 0 0 2.1950 7.5100 -1.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 6.2230 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 5.8650 -0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 7.7510 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 8.9290 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 8.5120 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5640 5.0020 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8350 5.4870 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 6.5020 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 6.9080 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 4.3540 1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 4.0920 2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 4.9200 4.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 4.7810 6.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 4.9160 8.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 5.1950 8.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 5.7600 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5940 6.5440 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9760 6.1150 4.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 7.0070 0.0430 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1470 7.3710 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 44 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 16 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END