IBS-ZINC05460329 MOE2007 3D Structure written by MMmdl. 48 52 0 0 1 0 0 0 0 0999 V2000 0.2670 9.2770 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 8.0000 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 7.6640 -2.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 6.4670 -3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 5.5890 -2.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 5.8910 -0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5130 7.1070 -0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 4.9620 -0.0540 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5700 5.2510 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2700 5.0320 -0.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 3.9160 0.3960 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0350 3.8980 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4870 2.5800 0.1050 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 2.5400 -0.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 3.5740 -0.1810 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 3.0770 -0.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 3.6940 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 2.8480 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 1.4550 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 0.8390 -0.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 1.6900 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 4.1550 1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3410 3.4800 2.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 3.7570 4.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3990 4.7080 4.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1860 5.3910 3.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0490 5.1160 2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5280 4.9680 5.9350 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 9.1050 -0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 9.6570 0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 10.0550 -1.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1490 8.3360 -3.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 6.2200 -4.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2660 4.6650 -2.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6300 7.3690 0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 4.8960 -1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6650 6.0220 -0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0490 1.7380 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3540 4.7630 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3540 3.2810 -0.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 0.8420 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1560 -0.2310 -0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 2.7290 2.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8740 3.2350 4.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9010 6.1300 4.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6760 5.6610 1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 1.4210 -0.3420 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8810 0.4930 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 47 2 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 47 48 1 0 0 0 0 M CHG 1 47 1 M END