PUBCHEM-ZINC06467844 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 1 0 0 0 0 0999 V2000 -0.7990 -0.3750 -0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 -1.0450 0.1520 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4540 -1.8620 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3980 -1.6600 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 -2.1720 0.3920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 -0.0360 1.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -0.2650 2.4420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1150 -0.4780 2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7260 -1.4170 3.1600 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7470 -2.3020 2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1930 -0.9460 3.3300 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6380 -0.7100 2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 0.2400 4.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 1.3550 3.4940 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1430 1.5590 2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 1.0620 3.2070 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2740 1.8850 2.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 1.0500 4.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 0.1900 4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7870 2.5480 4.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 2.7650 4.6420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5530 1.8750 4.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -1.9640 3.9110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -1.8980 4.3930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -1.8570 5.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -2.4820 4.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -2.6510 3.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8010 -2.8870 5.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 0.4590 -1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -1.0810 -1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 0.0460 -0.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3540 3.4610 4.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 2.3610 5.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 -2.0940 3.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 -0.8700 5.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 -2.0760 6.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -2.6190 5.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6520 -3.2670 5.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5100 -1.6100 -1.7130 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 16 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 20 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 23 34 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 38 1 0 0 0 0 M CHG 1 39 -1 M END