PUBCHEM-ZINC05801014 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.3490 1.9980 1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 1.8400 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 0.9890 -0.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 0.2950 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 0.4530 1.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 1.3040 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 -0.5650 0.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 -0.0510 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3330 1.2960 0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 2.2980 0.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8280 1.2490 0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4870 2.2490 0.6340 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1870 -0.0410 0.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -0.8670 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0110 -2.0450 -0.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5420 -0.4700 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6030 0.4510 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9250 0.0370 -0.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2210 -1.3120 -0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1960 -2.2450 -0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8740 -1.8290 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -1.8930 -0.0670 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1550 -2.6330 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -4.0900 -0.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -4.9790 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -6.4430 -0.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7860 -6.7270 -1.0070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 2.6640 1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 2.3810 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 0.8740 -1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -0.0800 2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 1.4290 3.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4460 1.5210 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7200 0.7760 -0.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2460 -1.6340 -0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4180 -3.3040 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1280 -2.6160 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -2.4340 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6510 -2.5780 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -2.2110 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0090 -4.1280 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -4.4850 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -4.9570 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -4.6000 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -7.1930 -0.9080 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 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 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 14 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 M CHG 1 45 -1 M END