E=-3287.74905923 Eh H=-3287.624296 Eh G=-3287.677036 Eh 18 0 1 C -0.109429 1.483641 -0.000084 C -1.490179 1.327376 -0.000054 C -2.028190 0.046642 0.000014 C -1.206099 -1.074545 0.000056 C 0.173157 -0.911778 0.000027 C 0.735250 0.369251 -0.000045 C 2.205119 0.573406 -0.000079 C 3.130379 -0.617683 0.000038 F 2.930730 -1.387111 1.078272 F 4.403678 -0.223491 0.000026 F 2.930769 -1.387295 -1.078073 N 2.748061 1.794399 0.608730 N 2.748050 1.794269 -0.609161 H -2.143766 2.191721 -0.000083 H 0.305773 2.485794 -0.000136 H 0.803899 -1.792505 0.000059 H -1.642873 -2.066210 0.000110 Br -3.904070 -0.175322 0.000051