%chk=000187794.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187794

0 1
Cl 7.193296 0.135530 -0.042188
N 0.431478 1.018349 -0.197851
C -3.311571 0.725403 -0.153601
C -3.362971 -0.675757 0.137326
C -4.569563 1.543800 -0.283730
C -4.679279 -1.401293 0.241758
C -5.828387 0.701580 -0.519406
C -5.876023 -0.469930 0.465677
C -0.917302 0.628621 -0.128669
C -0.949628 -0.775039 0.166021
C -2.093729 1.381679 -0.289217
C -2.195741 -1.412078 0.296710
C 0.413385 -1.223762 0.260980
C 1.233497 -0.127235 0.035085
C 2.694624 -0.049040 0.020216
C 3.430143 -1.024510 -0.676949
C 3.366697 0.978957 0.704283
C 4.825054 -0.972533 -0.698130
C 4.761767 1.040575 0.687483
C 5.468931 0.062900 -0.016161
H -4.691292 2.141433 0.646128
H -4.462339 2.282713 -1.103765
H -4.831189 -1.983341 -0.693068
H -4.638413 -2.149723 1.059217
H -6.730200 1.332370 -0.414349
H -5.837500 0.320738 -1.559425
H -6.820296 -1.033255 0.350860
H -5.868204 -0.089886 1.505865
H -2.042614 2.442243 -0.509828
H -2.226715 -2.476311 0.519956
H 0.772033 1.929464 -0.430877
H 0.722396 -2.224752 0.481321
H 2.905752 -1.822543 -1.205105
H 2.800744 1.722707 1.265029
H 5.401246 -1.724859 -1.236895
H 5.289513 1.833384 1.217397


%chk=000187794-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187794

0 1
Cl 7.367818 0.180602 -0.034276
N 0.433308 0.995232 -0.066343
C -3.340138 0.735046 -0.053195
C -3.403978 -0.698718 0.059280
C -4.612367 1.582973 -0.075888
C -4.750145 -1.426819 0.066082
C -5.879309 0.780392 -0.441605
C -5.947557 -0.510930 0.401704
C -0.913293 0.616371 -0.040635
C -0.951201 -0.818730 0.071327
C -2.088304 1.389198 -0.106788
C -2.216278 -1.457362 0.126101
C 0.417157 -1.277019 0.099617
C 1.252674 -0.152494 0.010147
C 2.716945 -0.060513 0.006280
C 3.509671 -1.199021 -0.318010
C 3.392479 1.153779 0.321933
C 4.916342 -1.135025 -0.325847
C 4.800765 1.236681 0.308589
C 5.546035 0.087508 -0.015643
H -4.760107 2.031571 0.929727
H -4.480115 2.432686 -0.773639
H -4.920168 -1.871184 -0.937744
H -4.707300 -2.277530 0.773423
H -6.777907 1.404460 -0.275296
H -5.861952 0.512613 -1.517310
H -6.894850 -1.051500 0.214523
H -5.931797 -0.244047 1.477816
H -2.048144 2.482338 -0.192122
H -2.277516 -2.549274 0.213584
H 0.771026 1.940709 -0.230144
H 0.752086 -2.306747 0.213786
H 3.018121 -2.139763 -0.585818
H 2.825199 2.043013 0.620432
H 5.513303 -2.015597 -0.579580
H 5.307096 2.173702 0.557631


