IBS-ZINC05455093 MOE2007 3D Structure written by MMmdl. 48 52 0 0 1 0 0 0 0 0999 V2000 2.6360 3.5720 -0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 2.9630 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 1.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 0.9470 0.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 1.7060 0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 3.0890 0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1110 3.7440 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1370 5.2550 -0.2620 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1560 5.6430 -0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 5.6020 -1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6510 7.1050 -1.7640 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2150 7.2690 -2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 7.6420 -0.7150 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 7.0130 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 5.9550 0.7600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 5.7710 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 4.9100 2.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 4.9980 4.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1910 5.9070 4.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 6.7780 4.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 6.6810 2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6320 7.9090 -1.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 8.6750 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 9.3760 -1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 9.3180 -2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5230 8.5710 -3.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 7.8690 -3.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 9.9920 -2.4000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 4.1720 -1.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 4.1970 0.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.8040 -0.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1020 0.9520 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0570 -0.1330 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1290 1.2200 0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 3.6560 0.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 5.2330 -2.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 5.1010 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 8.4570 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7940 4.2090 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 4.3430 5.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 5.9360 5.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 7.4890 4.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 8.7470 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 9.9680 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0550 8.5390 -4.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 7.2890 -3.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0410 7.3970 1.5760 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.7150 8.1520 1.6320 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 35 1 0 0 0 0 7 8 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