PUBCHEM-ZINC05139145 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 39 0 0 0 0 0 0 0 0999 V2000 -0.1890 1.6120 -0.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 0.0850 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -0.4430 -0.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -1.9090 -0.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -2.3510 1.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -3.8210 0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -4.2810 2.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7350 -2.4540 -0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -2.0930 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9370 -2.6350 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2880 -3.5310 -0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3710 -3.8890 -1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -3.3480 -1.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 -3.7300 -2.1320 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.4630 -4.4480 -3.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -3.3250 -2.0700 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.6750 -4.1200 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5150 -3.3020 -0.9210 F 0 0 0 0 0 0 0 0 0 0 0 0 -6.6290 -5.3990 -0.7220 F 0 0 0 0 0 0 0 0 0 0 0 0 -7.1690 -4.2040 1.1490 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -1.1860 1.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 1.9890 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 1.9150 -1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 2.0210 0.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0750 -0.3240 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -0.2170 0.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -0.0340 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2730 -0.1400 -0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 -1.7460 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -2.2350 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 -4.4260 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -3.9370 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -3.6770 2.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -4.1660 3.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -5.3290 2.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 -2.3580 1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6500 -4.5890 -1.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3810 -0.8990 1.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 -0.8430 2.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 21 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END