PUBCHEM-ZINC04545891 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 34 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.2500 0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 -1.8540 0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0140 -2.3610 0.0180 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6410 -1.7000 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 -3.7670 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -3.6980 2.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6370 -5.0840 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9530 -6.0290 2.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -2.4110 -1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8420 -2.0590 -2.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4170 2.0550 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9700 1.6240 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 3.5560 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5330 4.2510 -0.8480 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8940 -2.4740 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0410 -4.1800 0.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3400 -4.4060 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6110 -3.2860 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 -3.0600 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 0.6800 -1.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 -5.2670 3.9720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7900 -2.8470 -1.6270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 4.1220 1.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 1.6820 -1.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5720 2.0710 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 5.0890 1.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 -2.8610 -2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -6.1740 4.3070 H 0 0 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 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 28 1 0 0 0 0 12 13 2 0 0 0 0 12 29 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 31 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 27 31 1 0 0 0 0 28 35 1 0 0 0 0 29 34 1 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 M END