PUBCHEM-ZINC03870368 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 1 0 0 0 0 0999 V2000 1.1710 1.5260 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 0.2710 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -0.7280 1.2690 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3840 -1.4400 1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7750 -1.9260 -0.3200 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2330 -2.8740 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8530 -0.7100 -1.3280 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 -2.1170 -0.7730 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7330 -2.8220 -0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2920 -2.7520 -2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -2.1360 -3.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -4.0770 -2.1830 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7520 -4.8170 -3.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 -5.8960 -3.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3590 -5.6060 -3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -6.5860 -3.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 -7.8610 -2.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 -8.1570 -2.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 -7.1800 -2.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0070 -0.8690 -0.7600 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3280 -0.8080 -0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9820 -1.7900 -0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 0.5930 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4050 1.0570 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7610 1.3520 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2120 1.7990 2.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3100 1.9540 3.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9600 1.6630 3.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5070 1.2200 2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 0.0220 2.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6960 0.4220 2.9560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 0.6710 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2270 1.2920 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1050 2.1110 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 2.1930 0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7110 -4.5650 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -4.1430 -4.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7290 -5.2470 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -4.6060 -3.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -6.3550 -3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 -8.6230 -2.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -9.1490 -2.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1320 -7.4280 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5280 -0.0390 -1.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7310 0.5820 -1.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1790 1.3180 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4790 1.2360 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2650 2.0240 2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6570 2.2990 4.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2510 1.7770 4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4470 1.0030 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3060 1.2930 -0.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 -0.2030 -0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 1.2520 0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -1.5070 1.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4760 -0.8720 1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 0.1670 3.2230 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 55 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 55 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 57 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 55 56 1 0 0 0 0 M CHG 1 57 -1 M END