CHEMDIV-ZINC06921110 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 0.0400 1.3640 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 -0.0270 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -0.6880 0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 0.0660 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4450 1.4810 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 2.1160 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 3.8750 -0.0110 S 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 4.3130 -0.6800 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 4.1500 -0.6010 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 4.4410 1.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3830 4.5600 2.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3470 3.7550 3.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 4.1360 4.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 3.8450 3.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 4.6310 2.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 3.3900 5.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5660 2.2640 5.8550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7710 -0.6540 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7530 -2.0680 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -2.6990 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 -2.0280 0.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 -4.1990 0.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 -4.9000 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8570 -4.3750 0.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0220 -2.8760 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 0.0880 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9630 -0.1220 0.8060 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.9370 1.8380 0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7760 -0.6180 0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 2.0880 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2310 4.2240 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 5.6220 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3280 2.6840 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 3.9330 4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 5.2100 4.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1990 2.7710 3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 4.1000 4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2470 5.7020 2.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 4.3330 1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 -4.5260 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -4.4920 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 -5.9810 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 -4.7260 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8220 -4.5630 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7310 -4.9130 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 -2.7300 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7960 -2.5230 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 4.0100 6.6700 O 0 5 0 0 0 0 0 0 0 0 0 0 5.1890 0.8590 -1.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 6 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 21 2 0 0 0 0 4 5 1 0 0 0 0 4 18 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 48 1 0 0 0 0 18 19 1 0 0 0 0 18 26 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 49 2 0 0 0 0 M CHG 1 27 -1 M CHG 1 48 -1 M END