PUBCHEM-ZINC03622273 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 50 0 0 1 0 0 0 0 0999 V2000 -0.5620 0.9810 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4080 -0.4400 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -0.5750 1.2110 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5730 -0.0810 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -2.0460 1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 0.4880 3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4060 0.8010 4.7600 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1200 1.7580 4.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 0.8000 5.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4790 1.1440 7.1050 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 1.2370 8.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 0.9680 8.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 1.0750 9.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 1.4800 10.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 1.7480 10.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 1.6290 9.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 1.9310 9.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 0.9930 9.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 3.3970 9.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 0.8160 10.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6130 -0.2130 4.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -0.1180 5.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 1.3820 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 0.9890 -1.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 1.6560 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -0.8040 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -1.0790 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -2.5410 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -2.5800 0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -2.1680 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 1.3380 3.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -0.3820 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 -0.2040 6.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 1.5400 5.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0910 0.6680 7.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 1.5890 11.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1520 2.0570 11.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 1.7690 8.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9270 -0.0560 9.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 1.1380 11.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 1.1660 9.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 4.0690 8.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 3.6190 9.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 3.6410 10.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 1.7310 9.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 0.4780 11.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 0.0310 9.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 0.1180 2.4450 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.3830 0.9640 2.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5340 -0.4710 2.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 48 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 6 48 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 21 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 20 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END