PUBCHEM-ZINC05115440 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 0.0780 -0.0550 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 0.8310 2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 1.7740 3.6490 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2390 1.5860 4.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 3.2670 3.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 3.7050 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6480 3.1300 1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 1.6410 2.3230 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7960 1.3560 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 0.7040 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 0.1860 4.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 5.1580 1.9610 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 5.8510 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 5.3130 -0.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4340 7.3030 0.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 8.3170 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 8.3560 -1.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 9.6000 -2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 10.7850 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 10.7680 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5070 9.5160 0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 9.1580 1.9870 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 9.7740 2.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 7.8320 2.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -1.0940 0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 0.1440 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3290 0.0530 -0.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 1.1100 2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.1970 3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 3.8470 4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 3.5250 3.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 3.3750 1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 3.6940 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 3.2920 0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 -0.3380 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4280 0.8950 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 0.2140 5.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0790 -0.6530 3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5770 0.1220 4.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 5.7480 2.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 7.4380 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 9.6400 -3.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 11.7390 -1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5440 11.6910 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5590 0.8910 1.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 1.4810 3.7150 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5620 2.2050 4.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 46 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 46 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 45 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 40 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 24 2 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 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 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END