PUBCHEM-ZINC03622863 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 48 0 0 1 0 0 0 0 0999 V2000 -1.0950 0.8330 1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 0.4610 2.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7710 2.6920 1.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6270 3.3660 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 4.8520 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8140 5.3890 -0.8080 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1100 6.7990 -0.8980 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9290 7.2760 0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6070 6.9340 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0590 8.3670 -1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7630 8.9710 -0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1720 10.3020 -0.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8800 11.0410 -1.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1770 10.4510 -2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7600 9.1190 -2.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 8.3850 -3.8210 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2900 8.0550 -3.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0640 7.3860 -1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 7.2380 -1.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 7.7140 -2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 8.3560 -3.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 8.5230 -3.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 7.4980 -1.6070 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0250 -0.2570 1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 1.2220 2.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 1.2600 0.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5510 0.7980 3.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9430 -0.6100 2.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 0.6820 2.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 3.0850 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7920 2.8270 2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6080 3.2580 0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2830 2.8860 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 4.9930 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2720 5.3590 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8740 6.3730 -2.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1890 6.4340 -0.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0040 8.4110 0.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7210 10.7620 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2000 12.0770 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9590 11.0400 -3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 6.7300 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9460 8.7310 -3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 9.0340 -4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 1.1970 1.6700 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0700 0.8670 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 45 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 45 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 9 37 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 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END