PUBCHEM-ZINC00750030 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 71 0 0 0 0 0 0 0 0999 V2000 -0.0430 1.3870 -0.7560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -0.0310 -0.5810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -0.6530 -0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 0.0850 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5990 -0.5500 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9200 -0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -2.6630 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -2.0350 -0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -2.7860 -0.2440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -3.7830 -1.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -4.5280 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -5.1700 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4880 -4.1720 1.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -3.4280 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -5.9160 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8540 -5.2980 -0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 -6.0370 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9850 -7.4060 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7820 -8.0370 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -7.2950 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -7.9580 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -7.3100 0.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -9.2830 0.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -9.9420 1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -11.2340 1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -11.2870 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1730 -8.1480 -0.1120 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 -7.5850 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3180 -6.4670 0.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5980 -8.3260 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6090 -9.6100 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8000 -10.2970 -0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9820 -9.7150 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9770 -8.4430 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7940 -7.7430 0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2460 -7.8300 0.9330 N 0 3 0 0 0 0 0 0 0 0 0 0 13.2920 -8.4440 0.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2430 -6.7100 1.4120 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9740 1.7560 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6370 1.6340 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.8540 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3490 1.1550 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5120 0.0280 -0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -2.4110 0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 -3.7340 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -4.4930 -1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -3.2820 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2090 -5.2880 -2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0380 -3.8220 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6470 -4.6740 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -3.4620 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -2.6680 1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -4.1340 1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8880 -4.2360 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9610 -5.5510 -0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -9.0990 0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 -9.8000 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8490 -9.2760 1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 -11.5940 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -11.4190 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 -11.5050 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -11.6810 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 -9.0680 -0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6880 -10.0660 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8100 -11.2900 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9110 -10.2570 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7920 -6.7480 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 6 7 2 0 0 0 0 6 44 1 0 0 0 0 7 8 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 46 1 0 0 0 0 10 47 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 50 1 0 0 0 0 13 51 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 18 19 2 0 0 0 0 18 27 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 20 21 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 57 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 58 1 0 0 0 0 25 26 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 26 61 1 0 0 0 0 26 62 1 0 0 0 0 27 28 1 0 0 0 0 27 63 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 64 1 0 0 0 0 32 33 1 0 0 0 0 32 65 1 0 0 0 0 33 34 2 0 0 0 0 33 66 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 35 67 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 M CHG 1 36 1 M CHG 1 38 -1 M END