PUBCHEM-ZINC05488566 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -0.7780 -1.3690 0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -1.8340 1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7760 -0.8950 4.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -0.6290 4.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9240 -0.2510 1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1710 1.2390 2.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 1.6660 1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 3.1070 1.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4010 3.7780 2.4480 C 0 0 3 0 0 0 0 0 0 0 0 0 3.9320 3.5140 3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 5.2510 2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5870 6.2710 2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 7.6840 2.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1510 8.2970 3.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 9.6500 2.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9180 10.3940 2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 9.7890 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 8.4370 1.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 6.0380 4.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4040 5.3510 0.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0600 6.3470 0.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 3.9650 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 3.7060 -0.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8560 3.3480 2.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4680 2.9010 3.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7970 2.4740 3.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5320 2.4910 2.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9430 2.9420 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6150 3.3720 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -0.9090 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 -2.2220 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -0.6410 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7360 -2.3010 2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -2.5550 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5420 -0.2100 4.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 -1.9240 4.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 0.3990 4.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3280 -1.3050 4.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3970 -0.7710 5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -0.4770 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7170 -0.8720 2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 1.8090 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 1.4910 3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3220 1.1680 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 1.3800 0.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 7.7280 3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0050 10.1230 3.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 11.4450 1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 10.3710 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 7.9760 1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 6.9010 4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 2.8860 4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2610 2.1320 4.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5670 2.1580 2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5180 2.9590 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1800 3.7160 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -0.6490 2.5420 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0380 0.1430 2.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 57 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 57 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 5 57 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 2 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 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 52 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END