MAYBRIDGE-ZINC04333145 MOE2007 3D Structure written by MMmdl. 49 52 0 0 0 0 0 0 0 0999 V2000 -0.2420 4.5180 -0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9650 3.6370 -0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9480 2.2070 -0.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 1.3430 -1.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -0.0250 -1.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -0.5620 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4370 0.2560 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 1.6350 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3750 2.8120 -0.2430 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2350 4.0840 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 5.4750 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 5.5780 2.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5790 5.6980 3.8940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4160 6.8990 4.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5040 7.0550 3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 6.9260 1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 7.7890 5.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 8.1330 5.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 9.0450 6.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 9.6220 7.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 9.2460 6.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 10.5830 8.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 11.5200 8.2990 F 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 11.2690 8.3770 F 0 0 0 0 0 0 0 0 0 0 0 0 2.9710 9.9530 9.5320 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.1720 3.9500 -0.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 5.2770 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2450 5.0240 -1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 1.7400 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -0.6680 -1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -1.6270 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4280 -0.1680 -0.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 5.7210 -0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 6.2260 -0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 6.3990 2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 4.6190 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1980 4.8200 4.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7420 5.6660 4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2640 6.2890 3.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 8.0320 3.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 6.8930 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 7.7580 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 7.7180 5.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 9.3020 6.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 9.6220 7.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 5.6460 1.4530 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8030 4.8460 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 8.3690 5.6730 N 0 3 0 0 0 0 0 0 0 0 0 0 5.1920 8.0820 5.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 46 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 48 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 45 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 46 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 46 1 M CHG 1 48 1 M END