PUBCHEM-ZINC03796844 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 51 0 0 0 0 0 0 0 0999 V2000 0.2460 1.5040 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 0.0510 0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -0.7430 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -2.0770 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -2.8030 0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -4.2260 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 -5.0970 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -6.4830 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -7.0310 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4700 -6.1870 0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -4.8040 0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -4.0770 0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -2.7350 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2030 -2.0200 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -0.5700 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 0.0790 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6400 -0.6440 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 -2.0550 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 -2.8500 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2200 -3.2610 1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1190 -5.5730 0.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9950 -4.2180 2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8140 0.1000 -0.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5290 1.3760 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 1.7640 -0.1510 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 1.8150 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1530 1.9080 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 1.9700 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 -0.1950 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2060 -2.5980 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -4.7090 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7760 -7.1270 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -8.1080 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -6.6270 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7370 -2.2520 -0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8210 -3.7080 -0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3930 -3.7780 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4670 -2.3690 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3110 -5.9930 1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8370 -5.5210 -0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0300 -6.1710 1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2810 -3.2000 3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2380 -4.6150 3.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8820 -4.8570 2.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2960 2.1380 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4190 -4.1820 1.4480 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.1490 -3.7890 0.8390 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 2 15 1 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 14 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 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 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 12 13 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 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 20 46 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 46 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END