CHEMBRIDGE-ZINC04754948 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.5340 1.3540 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -0.0020 -1.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7370 -0.5590 -0.9550 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 -1.7540 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -2.3160 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1460 -2.3940 -0.0950 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8760 -2.0000 -0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0290 -3.9130 -0.2750 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1830 -4.2870 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3030 -4.5500 0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 -7.3520 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2090 -3.9240 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 -4.7850 1.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9190 -5.9860 0.5910 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7700 -5.8430 -0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1460 -6.7870 -0.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0630 -2.5080 1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6000 -2.0820 1.3340 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4710 -0.5800 1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 -2.7970 2.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8320 -4.2380 -1.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7900 -3.8680 -2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 -4.1660 -3.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -4.8340 -4.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -5.2030 -3.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6910 -4.9010 -2.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -5.9180 -3.9240 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1350 -6.1810 -5.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -6.2430 -3.1080 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4600 1.7720 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 1.2230 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 2.0320 -1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1720 -0.6800 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 0.1290 -0.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0000 -4.6080 1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 -1.8470 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3340 -2.4580 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 -0.0310 0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8890 -0.3430 2.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4190 -0.2960 1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -2.6460 3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6790 -3.3470 -2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3570 -3.8780 -4.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3300 -5.0670 -5.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 -5.1860 -1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 18 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 12 2 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 2 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 M CHG 1 27 1 M CHG 1 29 -1 M END