PUBCHEM-ZINC05493905 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 0.2420 1.2450 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -0.2270 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 -0.8030 -0.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -0.8490 -0.7220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -2.2750 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -2.5950 -2.3900 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7860 -2.1010 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0680 -4.0830 -2.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 -4.3810 -3.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8080 -3.2010 -3.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7650 -3.0360 -4.6240 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0970 -2.1330 -3.3960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 -5.7050 -3.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8980 -5.9630 -4.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -7.2730 -4.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5070 -8.3550 -4.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2990 -8.1080 -3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8830 -6.8040 -3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4880 -9.1220 -3.2640 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -9.7180 -4.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2550 -10.0550 -5.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0940 -10.2990 -3.3340 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 -11.7210 -3.6480 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -10.0000 -2.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2930 -9.5240 -3.6490 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2140 1.7110 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2160 1.7210 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3980 1.3910 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5630 -0.3040 -0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 -2.7920 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -2.5790 -0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -4.2980 -3.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -4.6700 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -5.1620 -4.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2860 -7.4380 -5.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -6.6880 -2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -11.1410 -6.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -9.6560 -6.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -9.6480 -6.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 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 5 31 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 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 20 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 36 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 M CHG 1 25 -1 M END