CHEMBRIDGE-ZINC04197586 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 0 0 0 0 0 0999 V2000 0.1710 1.3860 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 -0.1230 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -0.4870 1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2560 1.6480 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 2.0150 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1330 -0.2990 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 -0.1520 2.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0570 -0.1540 1.1650 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 -0.0290 3.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8540 0.1560 3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5940 -1.1450 3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0330 -0.9610 2.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8200 -0.8430 4.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3840 -0.8470 5.1900 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3130 -0.6970 3.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4990 -0.5210 5.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2020 -0.8960 6.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2630 -2.4070 6.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8760 -3.0330 6.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1820 -2.6550 5.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 1.6090 -1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 1.8320 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -0.5370 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7610 -0.5840 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -0.1260 2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -1.5720 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 2.0260 1.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 2.0380 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1650 1.6820 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4730 3.1040 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 -1.3600 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 0.2930 3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0100 -0.0590 4.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0560 0.9080 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1920 0.5670 4.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3890 -1.8980 3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2590 -1.5540 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4420 -0.9260 1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6360 -1.2820 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5210 0.3660 3.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3690 0.5640 4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0460 -0.8760 4.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2170 -0.4840 6.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6740 -0.4420 7.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9190 -2.8480 5.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7050 -2.6380 7.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9590 -4.1230 6.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2660 -2.7060 7.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7200 -3.0390 4.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1550 -3.0310 5.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 0.1430 1.3810 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8410 -0.2070 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1300 -1.1490 4.9800 N 0 3 0 0 0 0 0 0 0 0 0 0 11.5980 -0.8050 5.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 3 51 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 4 51 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 6 51 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 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 53 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 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 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 20 49 1 0 0 0 0 20 50 1 0 0 0 0 20 53 1 0 0 0 0 51 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 51 1 M CHG 1 53 1 M END