PUBCHEM-ZINC00627543 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.3440 1.0670 -0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.1480 -0.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -0.5740 0.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2570 -1.7670 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9310 -2.3150 2.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -1.6760 3.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -0.4830 2.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 0.0660 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -2.2940 4.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 -1.8190 4.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 -0.7220 4.7270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 -2.7090 5.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 -4.1050 5.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6400 -4.9330 6.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2350 -4.3770 7.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3970 -2.9920 8.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9570 -2.1410 7.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1440 -0.7360 7.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 0.0430 8.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9330 -0.3710 9.2960 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5890 1.5460 7.8340 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9370 1.6290 6.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1350 2.0530 7.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6060 2.2020 9.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 3.1010 10.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9560 2.6310 10.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4970 2.4360 8.7090 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4960 3.4330 8.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9870 2.0270 8.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3300 1.3150 7.6930 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3500 0.9800 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3490 1.2660 -1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 1.9070 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6150 -2.2770 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -3.2450 2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 0.0520 2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 0.9950 0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -3.1660 4.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 -4.5760 4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5390 -6.0130 6.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5940 -5.0210 8.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8960 -2.6070 8.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8950 -0.2510 6.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 3.0290 7.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4700 1.3850 7.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 2.6210 9.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5250 1.2160 9.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4550 4.1260 9.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 3.1380 11.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5590 3.3740 10.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 1.7020 10.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7050 2.5000 9.6070 O 0 5 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 M CHG 1 52 -1 M END