%chk=000230107.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230107

0 1
Cl 6.026329 3.074756 0.775971
Cl 4.982698 -3.951402 0.157129
N 3.797008 -0.138790 -0.328696
N -5.906997 -0.139372 0.477624
C 0.137571 -0.565879 0.149517
C -1.017691 -1.457148 0.548667
C -0.351207 0.700440 -0.299305
C -2.226178 -0.583713 0.287625
C -1.812395 0.689474 -0.212457
C 1.488774 -0.848425 0.183738
C 2.401852 0.152696 -0.246498
C 0.543106 1.674233 -0.716788
C -3.558765 -0.889423 0.472128
C -2.764602 1.650782 -0.517281
C 1.917813 1.401586 -0.687182
C -4.535656 0.098911 0.161726
C -4.121218 1.354087 -0.334764
C 4.754736 0.994255 -0.364673
C 4.316527 -1.349915 0.365458
C 4.833787 1.755858 0.963287
C 4.397021 -2.474309 -0.672810
C -6.908647 0.711467 -0.223285
C -6.341090 -1.563724 0.519565
H -0.954644 -1.763360 1.609917
H -1.045410 -2.387609 -0.048906
H 1.834824 -1.818050 0.528886
H 0.189461 2.643230 -1.064511
H -3.852720 -1.858844 0.862405
H -2.468186 2.626694 -0.896798
H 2.605848 2.170941 -1.031477
H -4.854832 2.120677 -0.571112
H 5.758662 0.604298 -0.652359
H 4.455944 1.688153 -1.188895
H 5.323777 -1.163666 0.801516
H 3.671349 -1.656214 1.222246
H 3.861628 2.208991 1.241166
H 5.163703 1.115556 1.801072
H 3.412066 -2.699470 -1.124776
H 5.101597 -2.236347 -1.491098
H -6.935520 0.559759 -1.313547
H -7.912282 0.507892 0.184234
H -6.692444 1.775924 -0.021947
H -5.723531 -2.116315 1.249747
H -7.382448 -1.619483 0.876477
H -6.276018 -2.076098 -0.452836


%chk=000230107-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230107

0 1
Cl 6.314092 3.223064 0.249965
Cl 5.061350 -4.061541 0.008579
N 3.828049 -0.095199 0.007600
N -5.999009 -0.260943 0.109723
C 0.109411 -0.593663 0.171681
C -1.065852 -1.521631 0.472060
C -0.377795 0.685240 -0.236101
C -2.280350 -0.636024 0.197267
C -1.848462 0.659848 -0.219302
C 1.481099 -0.866801 0.250427
C 2.431164 0.154710 -0.073497
C 0.551974 1.694873 -0.563954
C -3.638379 -0.957124 0.310918
C -2.817726 1.640329 -0.523932
C 1.935966 1.433352 -0.479741
C -4.631511 0.033061 0.003883
C -4.188404 1.332486 -0.413674
C 4.812337 0.929082 -0.373940
C 4.349502 -1.382432 0.490994
C 5.072775 1.899748 0.794347
C 4.414399 -2.409291 -0.656280
C -6.998153 0.766419 -0.201854
C -6.432243 -1.591138 0.548873
H -1.047119 -1.883193 1.519154
H -1.056181 -2.421795 -0.173898
H 1.810161 -1.864937 0.556720
H 0.215318 2.688934 -0.879509
H -3.934697 -1.959781 0.633364
H -2.518906 2.644881 -0.845792
H 2.629370 2.241653 -0.730170
H -4.921214 2.108162 -0.652486
H 5.761812 0.438537 -0.653284
H 4.475177 1.491241 -1.262825
H 5.364609 -1.235743 0.901340
H 3.730475 -1.777469 1.316023
H 4.166945 2.443316 1.098136
H 5.531094 1.397947 1.659540
H 3.425127 -2.624273 -1.084417
H 5.119442 -2.108181 -1.445304
H -6.918501 1.115403 -1.252169
H -8.008396 0.350425 -0.060904
H -6.900682 1.653305 0.458266
H -6.062646 -1.832480 1.567362
H -7.532914 -1.630191 0.571795
H -6.078905 -2.389081 -0.136885


