PUBCHEM-ZINC00863168 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.6710 0.9100 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4160 -0.5700 0.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 -0.7600 0.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -2.0270 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6830 -2.2810 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 -3.5660 -0.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -4.6110 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -4.3530 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 -3.0640 0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5980 -5.9940 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 -6.5520 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 -7.7890 -0.2890 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 -8.4990 -1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3130 -8.0090 -1.7820 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 -6.7740 -1.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -6.2640 -2.1820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -7.0220 -3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -8.6140 -3.4120 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -6.5260 -3.7050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -7.3410 -4.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -8.1430 -5.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -8.9470 -6.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1830 -8.9530 -6.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -8.1550 -5.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1010 -7.3450 -4.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -9.7890 -1.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 1.0550 1.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 1.5030 0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 1.2270 2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -0.8870 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -1.1630 1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3970 -1.4710 -0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -3.7630 -0.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -5.1600 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -2.8630 0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -5.9830 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -5.3620 -1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -5.6040 -3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -8.1400 -5.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2990 -9.5720 -7.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -9.5820 -6.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9100 -8.1620 -5.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6080 -6.7180 -3.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -10.1610 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2950 -10.3210 -2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 26 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END