PUBCHEM-ZINC05978729 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 -0.3550 1.6110 -0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 0.1770 0.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -0.5330 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 -1.9040 0.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -2.7140 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 -2.3760 -1.0510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8020 -4.1280 0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1900 -4.3110 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5700 -4.8330 0.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5960 -6.3600 0.6660 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.9870 -6.8560 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0300 -8.3780 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9410 -8.8810 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5540 -8.3900 -0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5220 -6.8560 -0.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8150 -6.4540 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 -6.3010 -0.0740 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6070 -6.3650 -1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -7.0560 0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -7.7960 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -8.4890 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -8.4640 2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -7.7480 3.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -7.0540 2.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -9.1730 3.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 -9.1220 4.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3260 -6.8790 1.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 2.1000 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 1.6470 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 2.1870 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -0.3650 0.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 0.1710 1.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 -0.0160 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 -0.5560 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1030 -2.2500 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -4.7060 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -4.1370 1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1920 -3.2160 1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 -4.6240 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2800 -4.4910 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8820 -4.3900 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7480 -6.5640 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2640 -6.3900 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9120 -8.8550 1.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0130 -8.6790 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9520 -9.9760 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1590 -8.5390 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2730 -8.8720 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8260 -8.7110 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -7.8480 -0.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -9.0530 0.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -7.7110 4.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1140 -6.5250 2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -9.7070 5.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -8.0950 5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3940 -9.5750 5.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1510 -6.8790 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1700 -4.7860 0.1270 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4830 -4.3860 -0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 58 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 8 39 1 0 0 0 0 8 58 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 46 1 0 0 0 0 13 47 1 0 0 0 0 14 15 1 0 0 0 0 14 48 1 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 58 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END