%chk=000193962.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000193962

0 1
Br 5.307123 -1.002860 0.050992
O 2.289510 -1.664379 0.045588
N 0.688735 2.834836 -0.041307
N 1.418022 0.524366 0.002735
N 2.977235 2.421408 -0.021174
N 5.301526 2.050489 -0.002027
N -3.863276 -4.456344 0.074706
N -6.100834 2.341684 -0.071373
C 0.945597 -2.133455 0.049465
C 0.343587 -2.420021 -1.188495
C 0.346799 -2.399701 1.293455
C -0.919116 -3.028958 -1.164936
C -0.915935 -3.009047 1.283148
C -1.534145 -3.318992 0.062375
C 1.020991 -2.078791 -2.468092
C 1.027295 -2.037943 2.565795
C 2.493819 -0.320133 0.023448
C 1.702636 1.876980 -0.018899
C -0.723482 2.639609 -0.045772
C 3.824104 0.123200 0.023131
C 4.034531 1.532818 -0.000039
C -1.500477 3.824187 -0.071519
C -1.353209 1.383295 -0.026747
C -2.887874 3.740918 -0.077980
C -2.744579 1.310173 -0.033381
C -3.518361 2.483035 -0.058978
C -2.825083 -3.948114 0.069185
C -4.945830 2.402979 -0.065782
H -1.422252 -3.275173 -2.100654
H -1.416591 -3.239853 2.224110
H 0.698633 -2.714595 -3.303247
H 0.812379 -1.033180 -2.750279
H 2.116617 -2.174954 -2.388787
H 0.718681 -2.671227 3.408098
H 2.123708 -2.119894 2.480792
H 0.806013 -0.993149 2.840755
H 1.017701 3.813283 -0.056259
H -1.023567 4.803138 -0.086376
H -0.768374 0.455148 -0.006538
H -3.490108 4.651614 -0.097818
H -3.235595 0.334070 -0.018532
H 6.124070 1.467365 0.012781
H 5.438876 3.051471 -0.018370


%chk=000193962-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000193962

0 1
Br 5.363198 -1.049077 0.051563
O 2.303739 -1.661080 0.055503
N 0.686524 2.804682 -0.045614
N 1.446042 0.536715 0.005424
N 2.964731 2.442226 -0.029480
N 5.283522 2.166012 -0.014102
N -3.927956 -4.513543 0.056098
N -6.192728 2.419596 -0.055198
C 0.956442 -2.158540 0.053650
C 0.360834 -2.457014 -1.195845
C 0.352987 -2.436742 1.303998
C -0.913572 -3.065321 -1.176278
C -0.921189 -3.045656 1.286365
C -1.557511 -3.360467 0.055499
C 1.067072 -2.124691 -2.492580
C 1.051050 -2.082166 2.599359
C 2.521427 -0.291797 0.026293
C 1.719344 1.874827 -0.022459
C -0.715203 2.647477 -0.045823
C 3.848999 0.172611 0.021090
C 4.039438 1.592320 -0.007375
C -1.494717 3.841417 -0.075497
C -1.376037 1.386808 -0.018472
C -2.895248 3.783276 -0.078076
C -2.780694 1.335638 -0.021273
C -3.560757 2.524718 -0.050995
C -2.852622 -3.989541 0.056521
C -4.996443 2.464029 -0.053713
H -1.410036 -3.315485 -2.119223
H -1.423649 -3.280503 2.230076
H 0.531443 -2.549248 -3.357263
H 1.130247 -1.029340 -2.634827
H 2.101546 -2.511344 -2.493660
H 0.509337 -2.491043 3.467817
H 2.085158 -2.469399 2.613817
H 1.114699 -0.984574 2.722981
H 1.041768 3.764503 -0.065093
H -0.995075 4.817817 -0.096763
H -0.781057 0.473132 0.004632
H -3.483143 4.705909 -0.101022
H -3.283965 0.363579 -0.000048
H 6.124368 1.593275 0.001847
H 5.347183 3.181305 -0.034654


