COMGENEX-ZINC06709241 MOE2007 3D Structure written by MMmdl. 44 47 0 0 0 0 0 0 0 0999 V2000 0.0520 3.9490 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 5.3450 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 5.8910 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 5.1000 -0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4480 3.7010 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 3.1120 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.6070 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 0.9130 -0.3570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 5.8770 -0.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3040 7.1290 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 7.1820 0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 8.3840 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8820 8.7110 1.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 8.4560 2.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 9.8650 2.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 8.3250 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4050 8.8850 1.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2730 10.2330 1.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9450 11.0460 0.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5550 10.5970 2.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 11.2700 3.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 12.1200 4.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 11.8890 3.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 3.5000 0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7160 5.9620 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 3.0820 -0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 9.2130 -0.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 8.2270 -0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7660 8.5840 2.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2640 8.0500 1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4680 8.1200 3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 10.4880 2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5230 10.4030 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1770 8.0210 -0.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7930 9.0680 -0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6680 8.2380 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 9.7470 3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 11.8560 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8210 10.6060 4.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8520 11.6660 5.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 13.1590 4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4330 11.7390 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2770 12.6630 2.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 1.1510 -0.1080 O 0 5 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 11 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 44 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 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 42 1 0 0 0 0 23 43 1 0 0 0 0 M CHG 1 44 -1 M END