IBS-ZINC05459527 MOE2007 3D Structure written by MMmdl. 45 49 0 0 1 0 0 0 0 0999 V2000 -2.8310 12.0870 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 12.1790 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3840 11.0530 -0.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6260 9.8390 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4320 9.7610 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0610 10.8650 1.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 7.7420 0.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 8.5280 -0.3200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 8.0350 -1.4320 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6220 8.4160 -1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3670 6.5050 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 6.0180 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7300 6.4430 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 6.4500 0.8750 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 4.5060 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 3.8880 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 2.4950 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 1.7070 0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 2.3010 -0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 3.6930 -0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -0.0080 0.3130 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 8.5450 -2.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 8.4770 -3.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7070 8.9420 -4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 9.4680 -5.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 9.5300 -4.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 9.0680 -3.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 10.0430 -6.7910 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 12.9920 1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 13.1540 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 11.1300 -1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6830 10.7820 2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4400 6.1380 -2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 6.1080 -1.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 5.9140 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9450 4.4820 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0990 2.0330 0.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9590 1.6870 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1350 4.1340 -0.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 8.0650 -2.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7640 8.8880 -4.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 9.9340 -5.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0710 9.1240 -3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 8.4410 1.4770 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.8990 8.0710 2.2890 H 0 0 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 8 1 0 0 0 0 5 6 1 0 0 0 0 5 44 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 7 44 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 22 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 35 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 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 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 38 1 0 0 0 0 20 39 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 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 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 42 1 0 0 0 0 27 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END