E=-2990.11597323 Eh H=-2989.970504 Eh G=-2990.017838 Eh 18 0 1 C -0.848298 -1.152768 -0.000244 C 0.540643 -1.182841 -0.000135 C 1.247240 0.013945 0.000111 C 0.584466 1.234926 0.000245 C -0.805500 1.253322 0.000131 C -1.541035 0.063973 -0.000114 C -3.027072 0.089614 -0.000237 N -3.701633 -1.069120 0.609955 N -3.701531 -1.068900 -0.610962 H 1.073221 -2.126804 -0.000239 H -1.394031 -2.090142 -0.000434 H -1.314774 2.210951 0.000233 H 1.150506 2.159166 0.000438 Br 3.138324 -0.020587 0.000265 C -3.762404 1.401675 -0.000094 H -3.511927 1.989875 0.887586 H -3.512085 1.989928 -0.887781 H -4.838341 1.222613 0.000004