COMGENEX-ZINC06869021 MOE2007 3D Structure written by MMmdl. 49 52 0 0 0 0 0 0 0 0999 V2000 5.1770 -4.1860 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 -2.8140 -0.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -2.1450 -0.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 -2.8290 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7910 -4.2150 0.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0150 -4.8860 0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -2.1060 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2130 -2.6720 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9470 -1.9220 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 -0.6690 0.3790 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -0.1820 0.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4800 -0.8460 0.6540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 1.4690 1.3640 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 2.1500 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 3.6450 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 4.2270 -0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3870 5.6100 -0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 6.4410 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 5.8530 0.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1500 4.4700 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8720 7.9330 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 8.6130 0.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 -2.4080 -0.4850 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4840 -3.8100 -0.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7890 -4.2300 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8650 -3.3380 -0.4070 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5540 -2.0110 0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 -1.4750 -0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1280 -4.7070 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0240 -2.2620 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 -1.0720 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9090 -4.7930 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 -5.9560 0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 -3.6640 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5830 1.8700 0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 1.7240 -0.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 3.6070 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 6.0460 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 6.4830 1.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8290 4.0420 1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5890 -3.9160 -1.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -4.5010 -0.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6630 -4.2670 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0790 -5.2320 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4240 -2.0170 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4130 -1.3740 -0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 -0.4620 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5010 -1.3950 -1.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 8.4040 -0.8410 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 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 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M CHG 1 49 -1 M END