PUBCHEM-ZINC05116860 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 24 0 0 0 0 0 0 0 0999 V2000 0.0030 1.4110 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8060 1.9850 0.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 0.1180 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4630 0.0140 -0.9780 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9080 -0.8240 -1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 1.1720 -0.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 1.3720 -1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 2.0260 -0.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 2.9920 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -1.0000 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7770 -0.8610 -1.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -3.1340 -2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -3.7180 -2.5490 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6960 -4.7030 -2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -3.1890 -2.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9500 -3.8910 -1.9550 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -3.5160 -1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9450 -4.8760 -2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 -1.9470 -0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -1.0210 0.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2290 0.1380 -1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2600 -0.9780 -2.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -1.8190 -1.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8130 -1.4530 -1.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 8 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 10 20 1 0 0 0 0 11 21 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 4 1 M CHG 1 13 1 M END