CHEMDIV-ZINC04077828 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 0.0580 1.5140 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 0.0010 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -0.5250 1.1800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -1.8860 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 -2.6190 0.3710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -2.3410 2.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 -3.7720 2.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -4.1880 3.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7100 -3.3250 5.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -1.8310 4.7680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -1.4630 3.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -3.7060 6.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -3.6340 6.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -3.2570 6.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -4.1110 8.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -4.2430 9.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -4.7380 10.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -5.0900 10.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -4.9380 9.7710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 -4.4500 8.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -4.1890 7.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 -4.3780 7.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6980 -5.6220 12.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -5.9180 12.3650 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0840 1.8930 0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 1.9640 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 1.8420 1.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -0.3640 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -0.3120 -0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -4.3540 1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -3.9810 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -4.0860 3.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3180 -5.2480 4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7930 -3.5060 5.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4260 -1.5850 4.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9910 -1.2230 5.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 -1.5870 3.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -0.4100 3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -3.9760 8.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -4.8560 11.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 -5.2000 10.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -5.7320 12.8670 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 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 11 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 23 42 2 0 0 0 0 M CHG 1 24 -1 M END