PUBCHEM-ZINC05955467 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7970 -1.1240 -1.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -1.4390 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 -0.8300 -3.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -0.2720 -2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 0.3710 -2.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 0.4420 -4.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 -0.1200 -5.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -0.7500 -4.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -0.0220 -6.9090 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -1.0960 -7.5240 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 0.1560 -7.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 1.4600 -7.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 1.4430 -7.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 2.6060 -8.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 3.7870 -8.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 3.8040 -7.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 2.6400 -7.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2570 -2.9520 -2.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5290 -0.7820 -2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 -1.5020 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 0.8120 -2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1170 0.9390 -4.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -1.1900 -5.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 0.5200 -7.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9190 2.5920 -8.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 4.6960 -8.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 4.7270 -7.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 2.6530 -7.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -3.3950 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 -3.1560 -3.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0140 -3.3820 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3080 -1.1750 -2.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 -1.0000 -3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4500 0.2960 -2.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -1.1410 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6610 -2.5870 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5590 -1.0530 0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 M CHG 1 3 1 M END