%chk=000244334.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244334

0 1
Br -5.788410 0.931251 0.029773
Cl 5.039417 -1.573307 0.042050
N -0.060437 -1.223166 -0.011655
N 1.221315 0.802396 0.099017
N 3.686344 0.672033 0.135225
N 2.557046 2.750232 0.155612
C -1.369953 -0.647175 0.006300
C 1.170680 -0.566607 0.027026
C -2.424647 -1.505574 0.393169
C -1.641741 0.677063 -0.377658
C 2.356693 -1.358562 0.001830
C -3.736221 -1.033715 0.398024
C -2.957715 1.142762 -0.366560
C -3.992047 0.287285 0.019421
C 2.483293 1.376088 0.139435
C 3.569590 -0.674166 0.059268
H -0.023919 -2.246726 0.021261
H -2.226809 -2.532198 0.695545
H -0.835023 1.350249 -0.682904
H 2.325837 -2.439249 -0.061723
H -4.550673 -1.695877 0.698657
H -3.167507 2.172757 -0.663102
H 3.450869 3.200623 0.289961
H 1.720215 3.298285 0.281329


%chk=000244334-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244334

0 1
Br -5.930821 0.857707 -0.038610
Cl 5.114598 -1.650340 0.225960
N -0.058033 -1.142471 0.140161
N 1.274210 0.837810 0.005531
N 3.718744 0.661754 0.038867
N 2.647747 2.731808 -0.126299
C -1.374248 -0.614598 0.093617
C 1.185428 -0.521329 0.106289
C -2.442538 -1.554214 0.142444
C -1.675832 0.771067 0.004339
C 2.354882 -1.350234 0.178431
C -3.784130 -1.128289 0.104090
C -3.020460 1.197874 -0.034010
C -4.062883 0.251514 0.015884
C 2.538252 1.368619 -0.024210
C 3.577267 -0.668870 0.137953
H -0.012897 -2.161099 0.211157
H -2.228911 -2.628595 0.210980
H -0.855507 1.487747 -0.034006
H 2.300686 -2.437113 0.259705
H -4.595138 -1.860813 0.142370
H -3.246739 2.266008 -0.102725
H 3.574405 3.149237 -0.150368
H 1.808115 3.301519 -0.178248


