PUBCHEM-ZINC06622439 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 1 0 0 0 0 0999 V2000 -0.0160 1.3420 0.0090 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 1.3180 -0.3820 -0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -1.2920 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 0.7470 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 1.7750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1960 -0.9190 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 -1.1180 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -2.2020 -2.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -1.9730 -3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9160 -2.9860 -1.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -0.8150 -3.3260 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4520 -0.2680 -2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9300 0.9320 -1.6890 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.4420 -0.2100 -4.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9040 -0.6430 -4.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6680 -0.0530 -5.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 -2.9000 -4.5740 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2260 -2.3250 -5.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1700 -3.9370 -4.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 -4.7430 -5.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 1.9650 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 0.7930 -0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -1.8820 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -0.4730 0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3780 0.8760 -4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0480 -0.5380 -5.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 -1.7290 -4.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2990 -0.3160 -3.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6070 -0.2850 -5.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9550 -4.5700 -3.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1220 -3.4280 -4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 -5.4240 -5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -4.1240 -3.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -3.5840 -4.6600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -4.1630 -5.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 12 2 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 35 1 0 0 0 0 20 21 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 21 33 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 M CHG 1 12 1 M CHG 1 14 -1 M END