%chk=000266319.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266319

0 1
Cl -8.393654 1.873940 -1.072694
Cl -7.933084 -2.723651 0.754965
N -5.976577 -0.124697 -0.054605
N 0.452104 -0.639624 -0.286935
N 1.656994 1.748282 0.743629
N 3.819372 0.835218 0.337783
N 4.068285 -1.385360 -0.627838
N -0.463113 2.586471 1.246071
N 2.229020 -2.714217 -1.207953
C -4.579906 -0.036167 -0.002478
C -6.697830 -0.239141 -1.342154
C -6.788751 -0.284201 1.171125
C -1.771109 0.219866 0.103667
C -3.813775 0.029268 -1.195615
C -3.904930 0.020393 1.245715
C -2.430141 0.146230 -1.133832
C -2.521422 0.141267 1.288092
C -0.303434 0.349478 0.158902
C -7.003080 1.139723 -1.931308
C -6.786555 -1.721170 1.697440
C 0.315463 1.578738 0.701046
C 1.822984 -0.490992 -0.227230
C 2.448164 0.702323 0.291489
C 2.709548 -1.540304 -0.689281
C 4.572377 -0.201795 -0.118495
C 6.048385 -0.061845 -0.067161
C 6.625408 1.074851 0.528579
C 6.878955 -1.058223 -0.611019
C 8.014687 1.208481 0.577953
C 8.267182 -0.916521 -0.557726
C 8.836249 0.215016 0.035997
H -6.094140 -0.831586 -2.072955
H -7.642002 -0.819780 -1.198265
H -6.401191 0.402164 1.964176
H -7.833108 0.059401 0.966261
H -4.295570 -0.026334 -2.167559
H -4.458377 -0.029874 2.178828
H -1.846855 0.179413 -2.056346
H -2.010444 0.172429 2.253061
H -6.147558 1.836391 -1.829776
H -7.276620 1.070988 -3.000854
H -5.788285 -2.196128 1.615925
H -7.107409 -1.764195 2.755400
H -0.010206 3.457070 1.498988
H -1.436422 2.648258 0.988567
H 5.981912 1.854162 0.951498
H 6.436182 -1.943733 -1.074538
H 1.235770 -2.890182 -1.243474
H 2.860911 -3.443622 -1.499008
H 8.456326 2.089706 1.039901
H 8.906375 -1.689640 -0.979610
H 9.919197 0.322254 0.076047


%chk=000266319-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266319

0 1
Cl -8.087048 1.777164 -1.680881
Cl -7.768798 -2.781694 1.261862
N -6.021074 -0.268894 -0.068284
N 0.463460 -0.374167 -0.457963
N 1.726639 1.599226 1.180381
N 3.858792 0.748632 0.571751
N 4.031188 -1.093433 -1.042188
N -0.343305 2.497265 1.714312
N 2.101546 -2.090782 -1.955532
C -4.631815 -0.087944 0.028644
C -6.653042 -0.638583 -1.344166
C -6.894616 -0.094572 1.101748
C -1.766484 0.316139 0.216700
C -3.770526 -0.266628 -1.103606
C -4.004882 0.278287 1.262813
C -2.384513 -0.080376 -1.000876
C -2.615869 0.479860 1.346549
C -0.293782 0.469420 0.278606
C -6.823767 0.524700 -2.332154
C -6.919808 -1.290553 2.065110
C 0.378587 1.513546 1.069631
C 1.831296 -0.264227 -0.380161
C 2.486758 0.693930 0.469623
C 2.680083 -1.159728 -1.137471
C 4.561920 -0.139938 -0.185613
C 6.045747 -0.089613 -0.090712
C 6.671359 0.855305 0.767075
C 6.850525 -0.979264 -0.851889
C 8.076869 0.906899 0.860732
C 8.256592 -0.924389 -0.755845
C 8.875257 0.018042 0.100191
H -6.061965 -1.431154 -1.846641
H -7.636168 -1.089005 -1.130664
H -6.584009 0.801349 1.677105
H -7.917546 0.116527 0.748913
H -4.179392 -0.554091 -2.076205
H -4.593787 0.394619 2.176768
H -1.749570 -0.235139 -1.879354
H -2.183001 0.705875 2.327992
H -5.900134 1.102237 -2.478625
H -7.229439 0.179113 -3.295795
H -5.914947 -1.646026 2.333842
H -7.514443 -1.071283 2.965703
H 0.190441 3.223617 2.190408
H -1.345022 2.600593 1.575389
H 6.030474 1.530116 1.342397
H 6.350965 -1.698869 -1.506781
H 1.083867 -2.142024 -1.985920
H 2.690736 -2.735153 -2.477188
H 8.552476 1.637679 1.524622
H 8.871264 -1.613638 -1.346031
H 9.968210 0.059830 0.174073


