PUBCHEM-ZINC06208939 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 54 0 0 0 0 0 0 0 0999 V2000 0.3780 1.4770 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 0.0400 0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -0.6730 1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -2.0310 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 -2.6480 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -3.8410 -0.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4520 -1.8980 -1.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6530 -2.3160 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -0.5800 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 0.0670 -2.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 -2.4960 2.4840 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1750 -3.6190 3.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -3.3020 4.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3390 -1.9480 4.5600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 -1.4840 3.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -0.3400 2.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5880 0.5440 2.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -1.1580 5.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1790 -1.0450 5.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -0.3310 7.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9700 -0.2230 7.3410 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7180 0.7970 6.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0030 0.5390 7.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 -0.6670 7.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8010 -1.1220 8.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7420 -1.1010 7.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -4.2290 5.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -5.4310 5.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -6.2920 6.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -5.9660 7.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 -4.7760 7.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -3.9090 6.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 1.6380 -0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 1.9600 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 1.9020 1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -4.6020 2.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -0.1610 5.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -1.6460 6.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -2.0420 5.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -0.4750 5.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 0.6660 7.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1130 -0.9000 8.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3550 1.6720 6.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8570 1.1630 6.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 -2.0240 8.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -5.6860 4.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -7.2220 6.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -6.6430 8.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -4.5280 8.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.9830 6.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 3 4 2 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 11 12 1 0 0 0 0 11 15 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 27 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 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 29 47 1 0 0 0 0 30 31 2 0 0 0 0 30 48 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 32 50 1 0 0 0 0 M CHG 1 11 1 M CHG 1 21 1 M END