PUBCHEM-ZINC05408546 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 59 0 0 0 0 0 0 0 0999 V2000 -0.1830 2.0550 -2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 0.6460 -2.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 -0.2350 -2.2950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -1.5720 -2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5230 -2.3970 -2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -3.7860 -2.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -4.3710 -2.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9940 -3.5440 -2.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -2.1520 -2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -5.8250 -2.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2280 -6.6740 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 -6.1530 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -6.0140 0.2050 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -5.8650 1.1920 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -5.4010 2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -6.3680 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -6.9890 2.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -6.0360 1.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -7.4330 4.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -8.0300 -1.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 -9.0000 -0.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 -8.8130 0.8530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 -10.3890 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6390 -11.4250 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -12.7470 -0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -13.0360 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 -12.0080 -1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 -10.6820 -1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 2.1150 -3.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 2.3450 -1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 2.7730 -2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 0.3750 -3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 0.6110 -1.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -1.9540 -1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2710 -4.4010 -1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -3.9740 -2.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 -1.5520 -2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -6.2010 -3.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -4.4040 2.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -5.3030 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -5.9780 4.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5740 -7.3640 3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -8.0090 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0240 -6.9970 2.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -6.4100 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 -5.0450 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -8.4290 4.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -7.0130 5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -7.4600 4.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -8.3300 -2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -11.2070 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -13.5520 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 -14.0670 -1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 -12.2440 -2.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8660 -9.9070 -1.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3690 -6.5290 3.6480 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7660 -5.6010 3.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 56 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 56 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 50 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 28 2 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 53 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END