PUBCHEM-ZINC06360454 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 30 0 0 1 0 0 0 0 0999 V2000 -0.4410 1.6840 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 0.1840 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 -1.2570 -1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -1.2350 -2.2270 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.7000 -1.7750 -3.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 -0.6600 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -1.9890 -0.8680 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5500 -2.0460 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 -2.5130 -1.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 2.5240 0.2310 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5740 2.2640 -0.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 4.0270 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 4.9200 0.5970 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0520 4.6680 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3040 6.4250 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 7.0540 -0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 2.2080 1.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 2.4330 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 1.9140 -0.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 1.9480 0.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.1660 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 -0.0630 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 4.2920 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 4.2370 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4390 -0.5810 0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -0.6730 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 6.7830 1.1880 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8630 4.7880 -0.3380 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0780 5.8290 -0.4690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6450 4.4360 -1.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 4.3320 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 25 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 17 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 28 1 0 0 0 0 15 16 2 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 25 26 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 31 1 0 0 0 0 M CHG 1 4 1 M CHG 1 27 -1 M CHG 1 28 1 M END