PUBCHEM-ZINC03757369 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.2450 1.5540 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 0.0360 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -0.4910 0.1070 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9230 -0.0530 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 -0.0580 1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3040 -2.0040 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -2.8500 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -4.2340 0.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 -4.8190 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -3.9930 -1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -2.5870 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -4.6400 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -6.0420 -2.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1230 -6.7720 -1.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -6.1600 -0.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -8.2460 -1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -8.9820 -0.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -10.3790 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 -11.0930 -1.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0250 -10.3700 -2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1240 -8.9720 -2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -12.6060 -1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9950 -13.2670 -1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -13.0840 -2.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 -3.9150 -3.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 -2.8830 -2.8210 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2540 1.8630 -0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4550 1.9410 -1.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 2.0240 0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -0.3790 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 -0.3080 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1160 -0.3570 2.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 1.0290 1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7690 -0.5040 1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.4470 1.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -4.8760 1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 -1.9290 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 -6.5410 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 -8.4630 0.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -10.8990 0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 -10.8840 -3.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2660 -8.4600 -3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5550 -12.9410 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -13.0330 -3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9280 -14.3570 -1.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8590 -12.9340 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -14.1710 -2.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -12.8400 -3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -12.6230 -1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8870 -4.4230 -4.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 15 2 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 2 0 0 0 0 M CHG 1 26 -1 M END