PUBCHEM-ZINC05444229 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 34 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 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 0.0220 -0.7450 1.0860 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.0360 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -3.1450 1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -4.4310 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0930 -5.6810 1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -6.6900 0.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0770 -6.1040 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -4.7660 -0.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -6.8390 -1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -7.8590 -1.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 -8.5420 -3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 -8.2360 -3.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -7.2330 -3.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -6.5370 -2.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -5.4710 -2.3660 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7620 -5.1910 -3.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8820 -4.8040 -1.2310 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0220 -2.0530 -0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -3.0220 -1.4790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.7470 -1.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.9950 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -5.7790 2.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -7.7480 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7470 -8.1010 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -9.3240 -3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -8.7820 -4.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -7.0020 -4.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M END