PUBCHEM-ZINC06016548 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.4530 0.5010 1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 -0.3190 2.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 0.1300 3.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 1.3250 4.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 1.4380 5.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 0.3470 5.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -0.8530 4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -0.9760 3.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6560 -2.0570 3.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 -1.7680 2.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -2.6420 1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 -3.8150 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0960 -5.1810 0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -5.7400 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3000 -7.1150 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -7.9250 0.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 -7.3870 0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1570 -6.0020 0.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 -5.2070 0.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -3.9710 0.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -3.2470 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6000 -7.7160 1.5650 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5790 -6.9500 1.9980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -9.0170 1.4640 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.2980 -3.3730 3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -0.2050 2.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 1.5520 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 0.1460 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 0.3900 0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 2.1750 3.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5970 2.3760 5.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0200 0.4360 6.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -1.7000 4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 -2.3980 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -5.1120 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 -8.9900 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7410 -8.0300 0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -4.1340 3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 -3.3760 3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -3.5860 2.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4000 0.8410 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -0.7840 3.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8530 -0.5890 2.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 2 26 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 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 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END