RDKit 3D 30 31 0 0 0 0 0 0 0 0999 V2000 -4.3636 0.9106 0.6993 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1005 0.5887 1.2786 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0547 0.3459 0.2853 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.6992 0.3875 0.9501 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4145 0.1940 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3508 0.1896 -1.3786 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5757 0.0096 -1.8858 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4567 -0.1069 -0.8746 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8170 -0.2967 -0.9039 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4473 -0.3693 0.3143 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7726 -0.2610 1.5141 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6917 -0.3749 3.1807 Br 0 0 0 0 0 0 0 0 0 0 0 0 2.4183 -0.0725 1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7452 0.0064 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3391 -0.9775 -0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4914 -1.3795 -0.6459 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2790 -1.8500 -0.6247 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 1.7804 1.2297 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0302 0.0144 0.7748 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2268 1.1621 -0.3739 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7318 1.3358 1.8914 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1192 1.1158 -0.4859 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6597 -0.3474 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6256 1.4097 1.4116 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5212 0.3162 -2.0369 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8285 -0.0375 -2.8827 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4102 -0.3883 -1.8074 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5279 -0.5170 0.3262 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8516 0.0159 2.4358 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2661 -2.8040 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 11 13 1 0 13 14 2 0 3 15 1 0 15 17 1 0 15 16 2 0 14 5 1 0 14 8 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 0 3 22 1 6 4 23 1 0 4 24 1 0 6 25 1 0 7 26 1 0 9 27 1 0 10 28 1 0 13 29 1 0 17 30 1 0 M END