PUBCHEM-ZINC03651600 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 40 0 0 1 0 0 0 0 0999 V2000 -0.8300 1.2920 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -0.1120 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3120 -0.6320 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -1.9400 1.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -2.7470 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -2.2490 -1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3160 -0.9400 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -0.3770 -2.3000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -1.1910 -3.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 -0.3300 -4.5590 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5380 0.1020 -4.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8250 -1.1110 -5.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9670 -0.5570 -8.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -0.7040 -8.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6710 0.4680 -9.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 0.7810 -4.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 1.1740 -4.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4590 0.1870 2.3410 N 0 3 0 0 0 0 0 0 0 0 0 0 1.0150 1.2860 2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -0.2850 3.4050 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.0280 1.9980 -0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 1.3910 -0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 1.5780 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -2.3310 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 -3.7640 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -2.9150 -1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -1.4920 -3.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5780 -2.0670 -3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -1.6700 -6.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -1.7780 -5.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -1.5180 -8.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -0.9990 -9.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 0.2360 -8.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -1.4730 -8.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6320 0.1630 -10.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7260 0.5670 -8.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2060 1.4560 -9.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0670 -0.0890 -6.9300 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.9830 0.3480 -6.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 0.6660 -6.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 31 1 0 0 0 0 13 38 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 38 39 1 0 0 0 0 38 40 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M CHG 1 38 1 M END