%chk=000250029.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250029

0 1
Br 4.179599 2.170756 0.605482
Cl -4.387488 -2.180548 1.633919
Cl -6.309735 -0.944362 -0.475874
O 6.088162 -0.315174 -0.125064
N 1.471643 0.955864 0.203927
N 0.170626 0.536804 0.060539
N 4.445744 -1.816329 -0.600895
N 3.172551 -2.204986 -0.735728
C -2.183396 0.762427 0.087156
C -0.828489 1.349534 0.278528
C -2.590153 -0.330307 0.865672
C -3.048674 1.317178 -0.870722
C 2.474007 0.027885 -0.067416
C -0.764743 2.784586 0.695321
C -3.874049 -0.851431 0.684517
C -4.327929 0.787885 -1.049282
C -4.739370 -0.295808 -0.266126
C 3.794421 0.416144 0.067079
C 2.203430 -1.344268 -0.487557
C 4.892721 -0.486971 -0.192395
H -1.912353 -0.774783 1.598308
H -2.719294 2.157192 -1.483106
H -0.213637 2.912820 1.639635
H -0.281903 3.413066 -0.067904
H -1.764499 3.213356 0.868390
H 1.706359 1.918493 0.486579
H -5.004042 1.211257 -1.794532
H 1.164959 -1.687506 -0.607262
H 5.152331 -2.538176 -0.810088


%chk=000250029-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000250029

0 1
Br 4.250962 2.324316 0.214410
Cl -3.966364 -2.902133 0.385553
Cl -6.551546 -0.938832 -0.172045
O 6.169439 -0.241124 0.056691
N 1.423361 0.904276 0.061552
N 0.120529 0.450970 0.011491
N 4.485830 -1.857601 -0.092230
N 3.204580 -2.331183 -0.151674
C -2.239297 0.809996 0.002232
C -0.856564 1.350013 0.057220
C -2.460618 -0.585373 0.187085
C -3.367950 1.640657 -0.240035
C 2.482271 0.006584 0.012290
C -0.586807 2.841353 0.165184
C -3.755300 -1.121085 0.133799
C -4.668177 1.098739 -0.294099
C -4.869249 -0.282745 -0.104970
C 3.814299 0.435841 0.066626
C 2.230949 -1.420221 -0.100517
C 4.932771 -0.497706 0.016324
H -1.605852 -1.238366 0.377005
H -3.251053 2.714567 -0.409745
H 0.069716 3.062453 1.031066
H -0.086275 3.231531 -0.743748
H -1.506248 3.422538 0.314314
H 1.657740 1.905090 0.127245
H -5.530831 1.742843 -0.486102
H 1.207242 -1.789589 -0.151351
H 5.219240 -2.571211 -0.132471


