PUBCHEM-ZINC06753342 MOE2007 3D CORINA 3.40 0006 02.08.2006 30 29 0 0 1 0 0 0 0 0999 V2000 -0.4780 1.8550 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 0.3480 -0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2010 0.0110 -0.6230 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7370 0.5850 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 -1.4790 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 -1.6000 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5190 -0.9330 -1.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9410 2.1750 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 4.1340 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 3.3860 1.8010 N 0 3 0 0 0 0 0 0 0 0 0 0 3.4660 3.7970 2.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 2.3900 1.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 5.4590 1.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 6.0750 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 5.8840 2.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 2.3240 -1.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 2.3090 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 -0.0730 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -0.1240 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -2.0830 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -1.8280 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 1.6050 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 1.9230 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 -2.2700 0.5140 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.7900 0.4310 -1.9270 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.3490 0.0200 -2.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9590 1.4320 -2.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -0.0380 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 3.6070 0.2370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 4.2490 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 8 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 25 1 0 0 0 0 5 6 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 10 1 M CHG 1 24 -1 M CHG 1 25 1 M END