PUBCHEM-ZINC05116450 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 1 0 0 0 0 0999 V2000 -0.0640 1.4340 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.0520 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -0.8090 1.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 -2.1040 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -2.1440 -0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0720 -0.8290 -1.0940 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0870 -0.3610 -2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -0.0820 -3.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9270 0.4680 -2.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 0.7270 -4.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 1.5150 -6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 0.1630 -5.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9890 -1.3180 -3.2970 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1720 -1.7660 -2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -3.2140 1.5830 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1430 -2.9650 2.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 -4.3460 1.0800 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7820 1.8290 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 1.8140 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 1.8180 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1110 -2.9660 -1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -1.1340 -3.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7110 0.5390 -2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 0.1580 -5.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 1.6740 -4.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5030 2.2940 -6.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9050 1.5410 -6.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 -0.7210 -6.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3370 0.0320 -5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 1.0790 -4.8030 N 0 3 0 0 0 0 0 0 0 0 0 0 3.2310 1.5140 -4.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 15 1 0 0 0 0 5 6 1 0 0 0 0 5 21 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 11 30 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M CHG 1 30 1 M END