%chk=000191206.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191206

0 1
Cl -2.873965 1.125421 -4.199609
Cl -3.276783 -0.038588 1.502655
O 4.316776 -1.800575 -1.515263
O 1.409821 2.720484 2.390616
N 3.564414 -0.479910 0.910485
N -0.360298 2.570677 0.987431
N 0.517850 -0.340388 0.890125
C 3.026722 -1.820000 0.562535
C 4.911924 -0.268207 0.302609
C 2.999507 -2.015021 -0.960288
C 4.858933 -0.499224 -1.218692
C 2.760184 0.641542 1.044485
C 1.391324 0.757548 1.047513
C -0.948164 2.184195 -0.254464
C -1.075096 0.829039 -0.635846
C -0.576541 -0.290122 0.201630
C 0.852244 2.060786 1.526748
C -1.421284 -1.520797 0.215089
C -1.436136 3.198187 -1.115926
C -1.676231 0.512559 -1.866743
C -0.920107 3.776597 1.660711
C -2.033610 2.877044 -2.328428
C -2.143043 1.529874 -2.692306
C -2.696486 -1.498569 0.798347
C -0.957236 -2.719800 -0.344811
C -3.509739 -2.633574 0.825732
C -1.763415 -3.861567 -0.326014
C -3.035096 -3.818986 0.256446
H 2.018863 -1.972670 1.017095
H 3.694433 -2.577346 1.036151
H 5.609782 -0.998816 0.775720
H 5.302930 0.742369 0.540475
H 2.795720 -3.061187 -1.249314
H 2.284012 -1.335623 -1.455068
H 4.257331 0.269042 -1.734756
H 5.866543 -0.557976 -1.669078
H 3.333095 1.572130 1.249457
H -1.333922 4.247307 -0.837095
H -1.782110 -0.532187 -2.171235
H -0.539336 4.709026 1.214159
H -0.615818 3.776870 2.727525
H -2.020201 3.761577 1.618237
H -2.407586 3.660309 -2.989588
H 0.037154 -2.756328 -0.788828
H -4.497018 -2.593148 1.286372
H -1.398228 -4.789725 -0.764154
H -3.659111 -4.712548 0.269859


%chk=000191206-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191206

0 1
Cl -4.120745 1.470841 -3.717416
Cl -3.582382 -0.319405 1.529319
O 4.966247 -2.552357 -0.714078
O 1.788385 3.069261 1.687143
N 3.487328 -0.408962 0.530606
N -0.366405 2.765334 0.889221
N 0.473325 -0.129664 0.474189
C 2.959725 -1.795557 0.558838
C 4.965874 -0.352466 0.436848
C 3.492230 -2.581139 -0.654018
C 5.441049 -1.162039 -0.788635
C 2.748185 0.729688 0.660176
C 1.355651 0.936585 0.637866
C -1.197295 2.411328 -0.226543
C -1.452003 1.053930 -0.594956
C -0.771641 -0.106493 0.038970
C 0.966811 2.316455 1.065483
C -1.471162 -1.437255 0.029421
C -1.846641 3.454478 -0.939647
C -2.349880 0.793003 -1.668157
C -0.719382 3.989131 1.649599
C -2.736862 3.188108 -1.998458
C -2.973727 1.846621 -2.348755
C -2.730258 -1.668485 0.637536
C -0.847717 -2.552860 -0.595646
C -3.357110 -2.930085 0.627822
C -1.455240 -3.824377 -0.622712
C -2.716538 -4.014808 -0.011213
H 1.858795 -1.746429 0.569266
H 3.308333 -2.280196 1.493174
H 5.406414 -0.791464 1.354792
H 5.293172 0.698445 0.354563
H 3.224500 -3.647450 -0.576443
H 3.072448 -2.159701 -1.593578
H 5.072242 -0.683341 -1.721767
H 6.541320 -1.224079 -0.816243
H 3.334260 1.645333 0.801088
H -1.654334 4.495893 -0.668183
H -2.555853 -0.241688 -1.955431
H -0.340854 4.913587 1.173108
H -0.254848 3.923990 2.644720
H -1.815850 4.040736 1.747503
H -3.228947 4.004735 -2.533914
H 0.122694 -2.390562 -1.077261
H -4.324933 -3.060299 1.120636
H -0.954428 -4.659856 -1.123106
H -3.200951 -4.996761 -0.025025


