PUBCHEM-ZINC05967481 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 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 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.9020 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -2.2930 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -3.8180 2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -4.1920 3.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5340 -5.5280 4.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1050 -6.5840 3.3770 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -6.5280 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4960 -7.7280 4.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -7.3370 5.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1690 -5.9780 5.1870 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7790 -5.1520 6.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7530 -4.8830 7.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3480 -4.0760 8.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 -3.7660 9.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2090 -2.9030 10.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7030 -8.3760 6.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2990 -8.0820 7.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5210 -9.6700 5.6900 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 -10.3710 6.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8630 -9.9980 4.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -11.1740 4.2910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3580 -9.0700 3.7330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -9.4930 2.5220 C 0 0 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -2.3180 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -2.2920 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -1.8760 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -1.9020 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.2340 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -4.2090 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -3.5040 4.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6370 -5.6740 6.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -4.2050 5.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -4.3600 6.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -5.8290 7.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6060 -3.2200 9.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -4.6890 9.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 -1.9800 9.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5390 -2.6660 11.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0730 -3.4490 10.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3600 -9.5830 1.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -10.4580 2.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -8.7540 2.2680 H 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 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 6 36 1 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 13 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 M CHG 1 13 1 M END