PUBCHEM-ZINC06693136 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 37 0 0 0 0 0 0 0 0999 V2000 -2.1270 0.1330 0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 1.3550 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 2.5660 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8410 1.0500 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 1.5210 3.5700 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 0.2030 2.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -0.2970 3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.0050 4.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5280 -0.5470 5.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6100 -1.3930 5.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8730 -1.6810 4.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -1.1400 3.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 -1.8980 6.7320 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 -2.7290 6.7420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1200 -3.1730 7.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2380 -4.0340 7.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1400 -4.7320 7.4110 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7590 -2.8190 9.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4220 -3.2610 10.2780 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 -1.9440 10.8450 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -2.0080 9.4910 N 0 5 0 0 0 0 0 0 0 0 0 0 -2.9540 -0.1610 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 0.3390 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -0.7290 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 1.5910 0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 2.3820 1.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8090 3.4430 1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6680 2.8150 0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -0.0910 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 0.6410 5.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -0.2970 6.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 -2.3290 4.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -1.3940 2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 -1.6110 7.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 -3.0370 5.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7570 -2.6960 11.3170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 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 18 1 0 0 0 0 16 17 3 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 36 2 0 0 0 0 M CHG 1 21 -1 M END