PUBCHEM-ZINC04818915 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 1 0 0 0 0 0999 V2000 -1.0950 0.9760 -0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 0.7400 1.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 2.9140 0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 3.4280 2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 4.8720 2.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 5.8880 1.6540 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8670 5.7930 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 7.2550 2.0620 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0790 6.9160 2.9360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 5.4290 3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 4.8050 3.6260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 7.6970 3.4750 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 8.0260 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 7.9610 0.4680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 8.8240 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 9.5680 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5680 10.2490 -1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7010 10.0730 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 9.0150 0.5490 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 5.7370 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 5.5610 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 5.4230 -1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7270 5.4600 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 5.6350 -1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9740 5.7690 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1930 5.6750 -2.7320 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.1600 5.5540 -3.9430 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2590 5.8290 -2.1640 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.2610 -0.0980 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 1.1830 -0.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 1.4810 -1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 0.8820 1.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 -0.3220 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 1.1230 2.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7750 3.4180 0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 3.1180 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2650 3.2240 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8500 2.9240 3.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0060 7.8250 2.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 9.6150 -1.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 10.8810 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 10.5350 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 5.5320 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6080 5.2860 -2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 5.3520 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9200 5.9020 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6290 1.4660 0.7980 N 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 47 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 47 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 20 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M CHG 1 26 1 M CHG 1 28 -1 M END