PUBCHEM-ZINC05368904 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 27 0 0 0 0 0 0 0 0999 V2000 -0.0620 1.4720 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.0440 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -0.5910 -0.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -0.9040 -1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -2.3000 -1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -2.5210 -3.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -2.6940 -4.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 -0.7670 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -0.5290 2.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4170 -1.2320 1.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9180 -1.3360 2.7220 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 -1.6500 2.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9760 -2.0280 1.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3010 1.9750 0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 2.3730 0.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.9560 -0.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 1.7470 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4050 -0.3100 -1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -0.5280 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1630 -0.8270 -1.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -0.1330 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -2.4280 -1.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1120 -3.0610 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 -0.5080 0.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4960 -2.2050 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3640 -2.1180 3.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7340 -0.3920 3.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8870 -1.4910 3.9890 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 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 8 1 0 0 0 0 4 5 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 6 7 3 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 24 1 0 0 0 0 10 25 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 12 13 2 0 0 0 0 12 28 1 0 0 0 0 14 15 3 0 0 0 0 M CHG 1 28 -1 M END