PUBCHEM-ZINC06563929 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 55 0 0 0 0 0 0 0 0999 V2000 2.6160 0.6600 -2.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0960 0.5350 -2.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 0.5020 -0.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 -2.0100 -2.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -2.6310 -1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5290 -4.0340 -1.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -5.0710 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -4.3890 0.1140 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -5.6920 0.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -3.2180 0.9680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -4.5520 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -5.7190 -1.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7210 -5.8600 -1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -4.8450 -1.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2960 -3.6800 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9920 -3.5460 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2780 -2.7310 -0.6040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 -1.6150 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9620 -4.8950 -1.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4220 -6.1180 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3610 -0.3950 -4.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 0.5850 -5.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 0.0640 -3.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -0.1810 -1.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 0.7230 -3.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8930 1.5720 -1.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 1.4260 -2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 1.4460 -0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 0.3830 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -0.2950 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -2.6940 -3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -1.8330 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -2.6070 -2.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -2.0510 -0.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7250 -4.9290 -2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -6.0710 -1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -5.0200 -3.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 -6.5290 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -6.7770 -2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -2.6690 0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9060 -1.0060 0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7440 -1.9320 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 -0.9910 -0.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4860 -6.0030 -2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 -6.3390 -3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3210 -6.9440 -1.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -1.3500 -4.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 1.5990 -4.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 0.2560 -5.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5390 0.6460 -5.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4450 0.1540 -4.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0320 -0.6520 -2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5760 1.0430 -2.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -0.6760 -3.0340 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5610 -0.8540 -3.6120 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 54 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 54 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 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 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 47 1 0 0 0 0 21 54 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 54 55 1 0 0 0 0 M CHG 1 54 1 M END