PUBCHEM-ZINC06272750 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 69 0 0 1 0 0 0 0 0999 V2000 0.1640 1.8530 0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 1.6560 2.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.3060 1.9260 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9910 2.0760 1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 1.0660 3.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.3790 3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5560 0.3090 2.7370 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1210 -0.7500 1.7330 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4060 -0.9150 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -0.0580 1.1610 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2000 0.1640 0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6810 -0.8790 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 -0.1650 0.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 0.8390 -0.1450 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0660 -0.7720 0.8030 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3270 -0.2610 0.2640 C 0 0 3 0 0 0 0 0 0 0 0 0 7.1840 -0.0770 -0.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7660 1.0370 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8220 0.8750 2.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9160 0.6580 2.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3940 -1.3550 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2310 -2.3380 1.1460 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5500 -1.1580 -0.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6180 -2.1430 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4350 -2.1580 0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9230 -3.5400 2.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7680 -4.8120 2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8010 -4.7830 1.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2590 -4.7050 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4370 -3.4290 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3380 -2.0280 2.3010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9970 -1.9660 3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8870 0.0450 3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 2.9350 2.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2330 1.0050 -0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 2.0480 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 2.7150 0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 0.4620 3.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 2.0130 3.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 -0.5950 4.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 0.9790 4.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 -1.1630 2.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -1.8120 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1170 -1.6190 1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7590 1.3510 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0690 1.8530 0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6530 -0.3230 -0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1650 -3.1260 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2590 -1.9070 -1.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0780 -1.2750 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7750 -2.1920 1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0940 -3.5850 3.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5320 -2.6470 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2490 -4.8930 3.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1530 -5.7080 2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0980 -4.7070 -0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6570 -5.5990 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0470 -2.5330 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9760 -3.4080 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5380 0.0210 2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -0.9180 3.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2660 0.8200 3.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 3.0840 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 2.9460 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9640 3.8140 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3240 -3.3920 1.0680 N 0 3 0 0 0 0 0 0 0 0 0 0 11.7130 -4.2080 0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 19 20 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 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 66 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 66 1 0 0 0 0 27 28 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 66 1 0 0 0 0 31 32 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 34 63 1 0 0 0 0 34 64 1 0 0 0 0 34 65 1 0 0 0 0 66 67 1 0 0 0 0 M CHG 1 66 1 M END