PUBCHEM-ZINC03464448 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -4.7540 -1.1490 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0200 -3.8700 -1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 -4.4990 -0.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8270 -3.2510 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -2.6270 0.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9820 -2.8290 0.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 -1.6160 1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4030 -1.3650 2.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8200 -1.9060 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1050 -1.6760 3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9740 -0.9040 2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5570 -0.3620 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2700 -0.5890 1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -5.9300 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 -5.7200 -3.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -6.7990 -4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -8.0870 -3.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -8.2960 -2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 -7.2180 -1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 -4.3720 -1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 -5.3480 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8010 -3.3280 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3330 -1.7430 2.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6690 -0.7670 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1410 -2.5090 3.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4320 -2.1000 4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9790 -0.7250 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2360 0.2400 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9420 -0.1620 0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -4.7140 -3.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 -6.6350 -5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 -8.9290 -4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 -9.3020 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -7.3810 -0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 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 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 2 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 M END