%chk=000116258.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000116258

0 1
Cl -0.038279 4.174629 -2.578089
O -0.085624 0.911435 2.282683
C -2.543342 1.639227 1.233551
C 2.517040 1.610317 1.174365
C -1.256296 2.069704 0.590186
C 1.218240 2.051587 0.561679
C -0.013058 1.681956 1.140136
C -3.043073 0.352862 0.625281
C 3.059517 0.349386 0.547276
C -1.248197 2.845895 -0.572211
C 1.200410 2.827769 -0.603939
C -2.394381 -0.854081 0.926256
C 2.217310 -0.741819 0.290863
C -2.841802 -2.062352 0.381330
C 2.722701 -1.922170 -0.267241
C -4.148358 0.349433 -0.232743
C 4.423116 0.254372 0.244515
C -0.026403 3.211740 -1.144409
C -3.961332 -2.065748 -0.482417
C 4.100921 -2.018426 -0.567604
C -4.600429 -0.855124 -0.778992
C 4.934563 -0.923389 -0.306888
C -2.132684 -3.335327 0.720635
C 1.796283 -3.063458 -0.540812
C -4.467416 -3.339826 -1.080050
C 4.673148 -3.265539 -1.160932
H -3.304724 2.442192 1.151404
H -2.388267 1.495854 2.329525
H 3.261057 2.434321 1.102331
H 2.392212 1.439859 2.270242
H -2.187529 3.154137 -1.033101
H 2.134633 3.117851 -1.085855
H -1.527980 -0.836190 1.590749
H 1.151367 -0.667608 0.510109
H -4.657522 1.277471 -0.479866
H 5.090324 1.092237 0.432080
H -5.461584 -0.847468 -1.445295
H 5.997047 -0.985422 -0.538463
H -1.278730 -3.175665 1.391189
H -2.808478 -4.042209 1.223083
H -1.752476 -3.832133 -0.182609
H 1.810579 -3.339170 -1.605290
H 0.752871 -2.829783 -0.287300
H 2.080930 -3.955618 0.033656
H -5.343954 -3.184897 -1.721939
H -4.761379 -4.056105 -0.300101
H -3.697216 -3.822653 -1.697690
H 4.217801 -3.485285 -2.137396
H 4.494636 -4.134926 -0.512676
H 5.757025 -3.199048 -1.319667
H 0.824779 0.695705 2.629055


%chk=000116258-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000116258

0 1
Cl -1.082880 4.627860 -2.556606
O 0.642640 0.874987 1.831873
C -2.131007 1.436932 1.605699
C 2.737706 1.993223 0.091525
C -1.099411 2.061190 0.669144
C 1.254913 2.302201 -0.092034
C 0.279932 1.745911 0.785621
C -2.811607 0.202345 1.007617
C 3.083034 0.500805 0.157747
C -1.502406 2.948932 -0.356618
C 0.822740 3.177035 -1.115995
C -2.066625 -0.974734 0.740252
C 2.549033 -0.414612 -0.786525
C -2.661556 -2.128303 0.179499
C 2.878746 -1.789412 -0.769280
C -4.192149 0.203681 0.702349
C 3.970707 0.003591 1.143631
C -0.543337 3.488404 -1.230080
C -4.057850 -2.116686 -0.128558
C 3.781606 -2.280063 0.227046
C -4.800668 -0.943351 0.142716
C 4.312212 -1.368019 1.169796
C -1.819202 -3.363832 -0.090045
C 2.274506 -2.730125 -1.795834
C -4.734978 -3.334946 -0.732204
C 4.162445 -3.748260 0.277468
H -2.901196 2.191999 1.848519
H -1.626615 1.159636 2.548108
H 3.295019 2.457006 -0.744699
H 3.107815 2.481766 1.016141
H -2.561584 3.200430 -0.470513
H 1.550428 3.613353 -1.807714
H -0.997062 -0.986554 0.982857
H 1.850051 -0.044212 -1.546940
H -4.794656 1.098513 0.902535
H 4.403141 0.688184 1.884104
H -5.873063 -0.927492 -0.088112
H 5.001224 -1.736900 1.938976
H -0.766852 -3.196082 0.197647
H -2.189265 -4.242255 0.474023
H -1.839087 -3.644952 -1.161368
H 3.056019 -3.226624 -2.402701
H 1.600921 -2.192870 -2.484111
H 1.689768 -3.537292 -1.312849
H -5.808507 -3.148167 -0.906046
H -4.648694 -4.220311 -0.072373
H -4.280248 -3.617028 -1.701777
H 4.645251 -4.074979 -0.663701
H 3.275297 -4.395455 0.418681
H 4.863336 -3.951271 1.104704
H 1.560011 0.515305 1.687011


