PUBCHEM-ZINC05113400 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 35 0 0 0 0 0 0 0 0999 V2000 0.4540 1.5020 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 0.1640 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -2.2260 -0.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9820 -2.7690 0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4360 -4.6790 1.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4250 -5.7130 0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2340 -5.9710 -0.2360 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 -0.3530 -2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1010 -0.2370 -3.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 -0.3090 -2.8140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 3.6390 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 3.8730 2.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 2.8300 3.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 1.3100 0.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 2.0130 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -0.3460 0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 0.2990 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -2.7590 -1.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0130 -2.3480 -0.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0170 -2.7510 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -2.1370 1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7910 -5.2070 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 -3.9000 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 0.6180 -2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -1.1060 -3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 4.4500 0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 3.6240 0.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -0.7510 -1.2100 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3040 -0.6080 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5860 -4.1360 0.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 -4.7720 -0.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2750 -6.1870 1.8000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9270 -0.1070 -4.7740 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.1320 2.3540 0.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 1.9060 1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 5.0540 2.9370 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 15 1 0 0 0 0 1 34 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 3 19 1 0 0 0 0 3 28 1 0 0 0 0 4 20 1 0 0 0 0 4 21 1 0 0 0 0 4 30 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 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 8 9 1 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 33 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 34 1 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 1 28 1 M CHG 1 32 -1 M CHG 1 33 -1 M CHG 1 36 -1 M END