PUBCHEM-ZINC04350404 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7420 -0.5060 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 -1.3900 2.1010 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3040 -1.7530 3.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -0.5320 2.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0600 -0.0950 1.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -0.5330 -0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0130 -0.1800 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -2.0450 0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -2.5150 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -3.8480 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -4.7640 0.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6350 -4.3240 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -2.9210 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -2.4720 -1.9470 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.1100 -5.2220 -1.5170 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.8010 -6.0880 0.7150 F 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -4.2720 2.5390 F 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -0.4680 -1.1890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -0.0860 -1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 0.6160 -0.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7380 -0.5200 -2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0670 -0.1250 -2.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 -0.5340 -3.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -1.3340 -4.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8520 -1.7280 -4.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -1.3310 -3.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 -1.7680 -5.9450 N 0 3 0 0 0 0 0 0 0 0 0 0 6.0940 -1.4220 -6.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 -2.4720 -6.7860 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6100 -1.0880 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0760 0.3470 1.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -0.3010 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9460 0.5190 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 0.4990 -1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8030 -0.2290 -3.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 -2.3520 -5.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -1.6440 -3.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 M CHG 1 29 1 M CHG 1 31 -1 M END