CHEMBRIDGE-ZINC01053085 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 66 0 0 1 0 0 0 0 0999 V2000 0.8030 1.2850 -0.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 0.0950 -0.1420 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -0.4470 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -1.6850 1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -2.3580 2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9310 -1.8020 3.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 -0.5450 2.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 0.1250 1.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -2.5560 4.3720 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0240 -3.5400 4.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0180 -2.7100 4.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -1.7500 5.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4350 -1.3080 6.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2850 -1.8380 5.6300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0540 -1.7070 6.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.2330 5.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0420 -0.8680 7.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 -0.7240 8.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7990 -0.1450 9.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7950 0.5090 11.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 1.9810 11.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 2.1610 10.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0840 1.5000 9.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7730 -1.3780 5.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2120 -0.5370 6.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 -0.0900 7.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5720 -0.4160 6.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5110 0.3010 7.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8460 0.1870 6.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2110 -0.6060 5.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2460 -1.3160 5.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9030 -1.2130 5.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7790 -1.8000 4.8890 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8490 1.1300 -0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 1.5490 -1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 2.1160 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4920 -2.1340 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -3.3190 2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 -0.0660 3.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 1.0910 1.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 -3.7160 4.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4800 -2.4660 3.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -1.3540 8.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 0.1100 7.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -0.1900 7.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8200 -1.7130 8.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9810 -1.2210 10.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5490 0.2990 9.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 0.4110 11.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -0.0170 12.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 2.5360 10.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 2.4040 12.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 3.2300 10.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7240 1.7360 11.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 1.9570 8.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9130 1.5670 8.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2280 0.9160 8.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6160 0.7270 7.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2570 -0.6740 5.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5270 -1.9320 4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 0.0340 9.3350 N 0 3 0 0 0 0 0 0 0 0 0 0 0.2510 -0.3990 9.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 13 2 0 0 0 0 12 24 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 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 61 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 19 48 1 0 0 0 0 19 61 1 0 0 0 0 20 21 1 0 0 0 0 20 49 1 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 21 52 1 0 0 0 0 22 23 1 0 0 0 0 22 53 1 0 0 0 0 22 54 1 0 0 0 0 23 55 1 0 0 0 0 23 56 1 0 0 0 0 23 61 1 0 0 0 0 24 25 1 0 0 0 0 24 33 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END