CHEMBRIDGE-ZINC02924918 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 -0.2520 1.5610 -0.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 0.6460 -1.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -0.1840 -1.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0020 -0.0940 -0.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 0.8140 0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 1.6420 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1840 -0.9970 -0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -2.0850 -1.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 -0.4870 -0.3640 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6070 -1.0970 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8710 -2.4080 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1470 -2.9510 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 -2.2030 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9070 -0.8860 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6310 -0.3180 0.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 1.1070 0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 1.5280 0.6570 O 0 5 0 0 0 0 0 0 0 0 0 0 9.5300 -2.7810 0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6700 -2.0940 -0.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9490 -2.6420 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1160 -3.8930 0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9870 -4.6110 1.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7100 -4.0400 0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1380 -5.9790 1.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3370 -6.4180 1.7830 O 0 5 0 0 0 0 0 0 0 0 0 0 13.3780 -4.5060 0.7570 N 0 0 0 0 0 0 0 0 0 0 0 0 14.6240 -4.0530 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8970 -2.9760 -0.1310 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7480 -4.9840 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0040 -4.4360 0.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0850 -5.2710 1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9190 -6.6550 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6750 -7.2060 0.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5900 -6.3740 0.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1220 2.2100 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 0.5800 -2.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -0.8950 -2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 0.8900 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 2.3510 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3540 0.4940 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1050 -3.0310 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3250 -3.9730 -0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6890 -0.2830 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5730 -1.1210 -0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7940 -2.0680 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8460 -4.5940 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2830 -5.4300 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1430 -3.3570 0.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0540 -4.8410 1.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 18.7580 -7.3070 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5470 -8.2860 0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6370 -6.8350 0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 1.7770 1.3050 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0940 -6.5890 2.0700 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 40 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 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 53 2 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 54 2 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 48 1 0 0 0 0 31 32 1 0 0 0 0 31 49 1 0 0 0 0 32 33 2 0 0 0 0 32 50 1 0 0 0 0 33 34 1 0 0 0 0 33 51 1 0 0 0 0 34 52 1 0 0 0 0 M CHG 1 17 -1 M CHG 1 25 -1 M END