%chk=000180127.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180127

0 1
Cl 8.403601 -1.281816 -0.000266
O 0.727584 1.259212 0.000186
O 1.547801 -0.896410 0.000375
N 2.942063 1.010443 0.000137
C -3.290732 0.167400 0.000007
C -4.732043 -0.174716 -0.000054
C -2.611010 0.325748 1.219048
C -2.611198 0.326986 -1.218975
C -0.609531 0.804245 0.000124
C -1.251480 0.644226 1.230820
C -1.251666 0.645460 -1.230633
C -5.132180 -1.519188 0.000183
C -5.695180 0.845006 -0.000349
C -6.492523 -1.839056 0.000121
C -7.053740 0.517330 -0.000401
C 4.241819 0.413006 0.000045
C -7.453818 -0.822952 -0.000169
C 5.350783 1.285987 -0.000128
C 4.423873 -0.982212 0.000119
C 1.741554 0.293067 0.000343
C 6.640525 0.756357 -0.000225
C 5.716477 -1.504841 0.000022
C 6.807720 -0.631391 -0.000149
H -3.147526 0.195193 2.159532
H -3.147858 0.197382 -2.159510
H -0.703417 0.766725 2.162442
H -0.703742 0.768904 -2.162213
H -4.382505 -2.309253 0.000406
H -5.382683 1.887880 -0.000528
H -6.803690 -2.882650 0.000299
H -7.801975 1.308425 -0.000624
H -8.512570 -1.075151 -0.000214
H 2.886462 2.034503 0.000036
H 5.213369 2.365591 -0.000186
H 3.561129 -1.659124 0.000256
H 7.508161 1.417906 -0.000357
H 5.871948 -2.585424 0.000080


%chk=000180127-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180127

0 1
Cl 8.828415 -0.589204 0.720909
O 0.782069 0.711346 -0.576592
O 1.778887 -0.938509 0.830366
N 3.012227 0.619830 -0.456573
C -3.404949 0.056136 -0.114715
C -4.878325 -0.131089 0.013682
C -2.490797 -0.783022 0.576640
C -2.863087 1.084993 -0.935298
C -0.594322 0.411374 -0.353936
C -1.092767 -0.623212 0.470517
C -1.473654 1.265036 -1.056533
C -5.439950 -1.425564 0.195687
C -5.764008 0.981062 -0.040931
C -6.834445 -1.601671 0.320235
C -7.158926 0.806355 0.080385
C 4.359436 0.291756 -0.145886
C -7.702531 -0.486544 0.262366
C 5.377804 1.056932 -0.774973
C 4.715507 -0.749509 0.751951
C 1.863049 0.017960 0.026907
C 6.737196 0.792806 -0.515497
C 6.077246 -1.013351 1.011402
C 7.070602 -0.242999 0.378618
H -2.874092 -1.564734 1.241591
H -3.534226 1.732537 -1.509681
H -0.411830 -1.273252 1.020342
H -1.057579 2.049408 -1.695707
H -4.783070 -2.302823 0.209017
H -5.355597 1.992698 -0.146377
H -7.244539 -2.609300 0.451958
H -7.820613 1.679124 0.043807
H -8.785376 -0.623000 0.357738
H 2.852063 1.389841 -1.109647
H 5.112702 1.862708 -1.470257
H 3.935828 -1.339940 1.236548
H 7.519507 1.382736 -1.000868
H 6.355947 -1.814119 1.702406


