RDKit 3D 52 54 0 0 0 0 0 0 0 0999 V2000 -4.4796 -2.4255 -0.6079 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0719 -1.9024 -1.8663 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8783 -1.2223 -1.8878 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0127 -1.0580 -0.8048 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -0.3344 -0.9449 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5053 0.2411 -2.1922 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3604 0.0692 -3.2829 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5393 -0.6605 -3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4014 -0.8386 -4.1855 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8808 0.8404 -4.9478 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.0949 -0.1626 0.2636 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0207 1.1743 0.9124 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2024 1.8013 1.0697 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2019 0.8257 0.4772 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4252 0.8916 0.5062 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4898 -0.2367 -0.0825 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1554 -1.4823 -0.4085 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4551 -2.3288 0.8332 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5173 -3.2645 0.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8045 -2.6670 0.8535 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8472 -3.7777 0.8328 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8617 -4.4148 -0.4434 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5808 2.8673 1.6148 O 0 0 0 0 0 1 0 0 0 0 0 0 -1.2915 1.6145 1.4373 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0918 0.7833 1.8717 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6928 3.0465 1.3886 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2872 3.9007 0.3533 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7303 5.2270 0.3238 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5877 5.6862 1.3168 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0157 4.8455 2.3394 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 3.5227 2.3733 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0108 6.9582 1.2877 F 0 0 0 0 0 0 0 0 0 0 0 0 -3.7722 -3.1768 -0.2486 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6161 -1.6265 0.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4444 -2.9236 -0.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2529 -1.4636 0.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4114 0.8230 -2.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1376 -1.3622 -3.8149 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1032 -0.9464 1.0065 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0833 -1.2386 -0.9357 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5409 -2.0480 -1.1157 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5637 -2.9086 1.0888 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6782 -1.7081 1.7089 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0148 -1.9357 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8124 -2.1722 1.8302 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8447 -3.3818 1.0346 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6020 -4.5493 1.5768 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9240 -4.4391 -0.7352 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6043 3.5518 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3965 5.8993 -0.4611 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6839 5.2245 3.1041 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8977 2.8625 3.1735 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 7 10 1 0 5 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 13 23 1 0 12 24 1 0 24 25 2 0 24 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 29 32 1 0 8 3 1 0 16 11 1 0 31 26 1 0 1 33 1 0 1 34 1 0 1 35 1 0 4 36 1 0 6 37 1 0 9 38 1 0 11 39 1 1 17 40 1 0 17 41 1 0 18 42 1 0 18 43 1 0 20 44 1 0 20 45 1 0 21 46 1 0 21 47 1 0 22 48 1 0 27 49 1 0 28 50 1 0 30 51 1 0 31 52 1 0 M CHG 1 23 -1 M END