PUBCHEM-ZINC01486750 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.7260 1.8760 1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 0.6990 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -0.2440 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6150 -0.0230 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 1.1690 1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 2.1110 1.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -1.0620 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 -0.5250 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4860 -1.5880 -1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 -2.1290 -0.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 -2.6640 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 -1.6000 1.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6160 -2.1860 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3660 -1.9660 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7630 -2.0400 0.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4370 -2.3550 -0.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7320 -2.5640 -1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3350 -2.4770 -1.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2080 -2.4570 -0.4520 S 0 0 0 0 0 0 0 0 0 0 0 0 12.6470 -2.7470 -1.8020 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6860 -1.2830 0.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5140 -3.8110 0.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9560 -5.1400 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9420 -5.5340 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9570 -4.7360 2.1810 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 2.6100 1.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 0.5130 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -1.1560 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0810 1.3780 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4200 3.0300 2.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0490 -1.9150 -0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 -0.1930 -1.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0630 0.3530 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9500 -2.4020 -2.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 -1.1180 -2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8850 -3.5330 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 -3.0310 1.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 -0.7880 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -2.0290 1.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8680 -1.7140 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3040 -1.8710 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2440 -2.8070 -2.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8040 -2.6800 -2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1760 -3.6900 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4770 -5.0920 -0.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7730 -5.8670 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2470 -6.5590 0.9590 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 M CHG 1 47 -1 M END