%chk=000196895.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000196895

0 1
Cl -4.891206 -2.859423 -0.106993
O 0.376891 -2.476640 -0.445882
O 1.517485 1.968183 -0.146204
N 4.645465 0.398376 -0.728199
N 0.996572 -0.273994 -0.318993
N -5.490731 0.052941 0.181509
C 3.118595 -0.883715 0.944704
C 2.423183 -0.744249 -0.442943
C 4.420243 -1.682089 0.692315
C 3.504300 0.493106 1.519684
C 3.317279 0.125287 -1.369380
C 5.282287 -0.903488 -0.331951
C 4.414748 1.225420 0.504138
C 0.007922 -1.321566 -0.326545
C 0.662963 1.100652 -0.164646
C -1.406782 -0.935953 -0.192375
C -0.782065 1.444505 -0.035215
C -1.784358 0.429122 -0.050516
C -3.153344 0.794764 0.076871
C -2.378529 -1.930490 -0.207112
C -1.135803 2.775045 0.100433
C -4.155270 -0.254783 0.059388
C -3.479917 2.174676 0.215261
C -3.730993 -1.591463 -0.082665
C -2.498971 3.141180 0.226872
H 2.457222 -1.428432 1.649471
H 2.360506 -1.777067 -0.897896
H 4.191861 -2.696829 0.325048
H 4.968264 -1.818674 1.639674
H 4.016660 0.371238 2.488028
H 2.601257 1.096524 1.719967
H 3.490317 -0.395240 -2.332197
H 2.850014 1.101936 -1.621766
H 6.284615 -0.680013 0.084953
H 5.447725 -1.504332 -1.248110
H 3.944583 2.183566 0.190777
H 5.397254 1.471356 0.949425
H -2.082432 -2.983986 -0.317023
H -0.358468 3.549561 0.109942
H -4.526016 2.470509 0.313654
H -2.754856 4.195138 0.332416
H -6.203860 -0.659884 0.166087
H -5.803408 1.003523 0.276295


%chk=000196895-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000196895

0 1
Cl -5.008645 -2.934844 -0.205877
O 0.375736 -2.512396 -0.332191
O 1.505221 2.031871 0.073398
N 4.658946 0.355935 -0.785722
N 0.975557 -0.240543 -0.198338
N -5.574141 0.011959 0.040934
C 3.192625 -0.822701 1.004534
C 2.409054 -0.682798 -0.339818
C 4.433391 -1.705463 0.678536
C 3.706237 0.533265 1.556651
C 3.293373 0.146882 -1.346306
C 5.271103 -0.961294 -0.431299
C 4.577991 1.212712 0.439981
C 0.002342 -1.303067 -0.232924
C 0.624369 1.123087 -0.027453
C -1.422254 -0.925923 -0.151842
C -0.829666 1.461318 0.028922
C -1.826491 0.438136 -0.030716
C -3.222746 0.793764 0.038545
C -2.401216 -1.936188 -0.201865
C -1.202722 2.808715 0.153045
C -4.224707 -0.260438 -0.017584
C -3.567976 2.175337 0.160462
C -3.759866 -1.594908 -0.135358
C -2.576073 3.164700 0.216421
H 2.552504 -1.333848 1.745843
H 2.300874 -1.710666 -0.725337
H 4.115599 -2.708129 0.334534
H 5.029729 -1.846268 1.599860
H 4.306680 0.336799 2.466420
H 2.868543 1.190083 1.841083
H 3.387922 -0.404021 -2.299819
H 2.859170 1.134808 -1.556646
H 6.304486 -0.771757 -0.088599
H 5.332908 -1.566383 -1.354578
H 4.139122 2.179898 0.146614
H 5.612214 1.391379 0.787563
H -2.080530 -2.977967 -0.295057
H -0.412830 3.564783 0.199834
H -4.616315 2.490891 0.214313
H -2.861149 4.217139 0.310822
H -6.239180 -0.759068 -0.001826
H -5.927987 0.959503 0.121144


