KEYORGANICS-ZINC04002659 MOE2007 3D Structure written by MMmdl. 41 44 0 0 0 0 0 0 0 0999 V2000 2.2710 10.5510 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 9.3380 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8760 7.1850 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 7.9330 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 9.2630 0.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 10.3970 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 11.0360 1.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 10.2690 2.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2920 10.8710 3.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 12.2410 3.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 13.0220 2.8590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7320 12.4220 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 12.8170 5.1810 F 0 0 0 0 0 0 0 0 0 0 0 0 0.9390 5.7440 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1410 5.0640 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1450 3.6770 -0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 2.9950 -0.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 1.5970 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 0.9510 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4550 1.6960 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 3.0860 -0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2220 3.7540 -0.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 5.0950 -0.3450 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1460 10.8680 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 10.2750 0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 11.3110 -0.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 7.6910 -0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 11.1020 -0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 10.0550 -0.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 9.1970 2.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 10.2810 4.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 14.0930 2.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5220 13.0490 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0740 5.5740 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0810 3.1340 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8210 1.0030 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -0.1310 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3980 1.1970 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 3.6580 -0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9010 8.0790 0.2470 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8830 7.8480 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 5 1 0 0 0 0 2 40 2 0 0 0 0 3 4 2 0 0 0 0 3 14 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 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 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 2 0 0 0 0 15 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END