COMGENEX-ZINC06713549 MOE2007 3D Structure written by MMmdl. 42 44 0 0 0 0 0 0 0 0999 V2000 -1.8100 7.7380 -8.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6040 8.1650 -7.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 7.6750 -6.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 7.1930 -5.5290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 6.8240 -4.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1930 6.7040 -3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 6.3270 -2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 6.0410 -1.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 6.1360 -2.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 6.5350 -3.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 6.5700 -3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 6.2040 -2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 5.8740 -1.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 5.3280 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 3.8160 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 3.1180 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 1.7240 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0050 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 1.6760 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 3.0800 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5410 0.9150 0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4250 -0.3930 -0.2850 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 0.9020 1.3310 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 1.4420 -0.7330 F 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 6.1810 -1.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2640 6.3320 -2.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5570 6.9870 -9.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 8.1360 -9.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 8.9160 -7.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 6.8700 -6.7420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 8.5180 -6.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9900 6.8990 -4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 6.2510 -2.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 5.7540 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 6.8550 -4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9720 5.6930 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 5.7430 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 3.6590 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 1.2020 -0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -0.0820 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2050 3.6000 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 6.0240 -0.4860 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 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 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 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 13 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 25 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 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 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 M CHG 1 42 -1 M END