PUBCHEM-ZINC05551697 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 36 0 0 1 0 0 0 0 0999 V2000 -0.1870 1.5330 0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 0.0330 0.0980 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6420 -0.2270 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -0.5470 1.3620 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7410 -0.3510 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2800 -2.0400 1.2920 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0630 -2.3670 2.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -1.9990 0.4820 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2230 -0.6320 -0.0320 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -2.9570 -0.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -2.8770 -1.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4300 -3.4850 -2.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -2.2280 1.3750 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2490 -1.3360 1.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1200 -1.8160 2.5210 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -3.0940 2.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 -3.3750 2.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8340 -4.5290 2.0920 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4040 -5.4260 2.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 -5.2900 3.6630 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -4.1100 3.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -3.9580 4.3660 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -2.6740 0.6210 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0970 0.0470 2.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 -0.1120 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 2.0740 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 1.8630 -0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 1.8210 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -2.6810 -1.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0290 -4.0020 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2970 -0.3550 1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9010 -6.3850 2.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8330 -3.0830 4.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6300 -4.7340 4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 24 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 24 25 1 0 0 0 0 M CHG 1 23 -1 M END