PUBCHEM-ZINC05472800 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 36 0 0 1 0 0 0 0 0999 V2000 -0.2470 1.4360 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1150 -0.0240 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.5320 -1.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9760 -1.8470 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -2.5820 -0.1860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -2.2730 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -3.7130 -2.5680 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8960 -4.3890 -3.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -3.8260 -4.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -5.9100 -3.5760 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4250 -6.1260 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5070 -6.4290 -3.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -7.9490 -3.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -8.6080 -4.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -8.1240 -4.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -6.5930 -4.6970 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3730 -6.2710 -5.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2680 -6.2630 -4.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6800 -5.6630 -3.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 2.0110 -0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 1.5440 -0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 1.8690 0.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 -0.1150 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -0.5900 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -1.9880 -3.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -1.8040 -2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6290 -4.2240 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -5.9920 -2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0350 -6.1020 -4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -8.2710 -2.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -8.2780 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 -9.6960 -4.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7290 -8.3860 -5.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -8.4780 -3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 -8.5910 -5.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9210 -6.6500 -5.6780 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 2 0 0 0 0 8 10 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 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 M CHG 1 36 -1 M END