PUBCHEM-ZINC05335578 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 -0.1670 0.5180 0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2930 -0.8360 0.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -1.6220 0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 -1.0460 0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 0.3090 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 1.0900 0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 2.5680 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 3.3220 1.4300 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0590 2.9180 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 4.7850 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 5.6120 1.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 3.1670 2.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 3.2880 3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 3.4380 4.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 3.5570 5.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 3.5270 6.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 3.3780 5.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 3.2640 4.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 3.1110 3.3630 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.6690 3.6560 2.2780 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 2.4410 3.7990 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.2940 3.6570 7.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 3.7950 8.2800 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.0530 4.7830 8.0960 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 2.5130 8.3000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 -2.9540 1.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0500 1.1300 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2730 -1.2830 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9830 -1.6550 0.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 0.7590 0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 2.7560 -0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 2.9110 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8260 2.9800 1.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 3.4600 3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9110 3.6730 6.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 3.3550 6.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -3.4960 0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6440 5.1680 0.5480 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7650 6.1160 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 26 37 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END