%chk=000279328.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279328

0 1
Cl -0.314300 -1.889777 1.652418
S -7.871551 -0.146636 0.087066
F -8.172243 -1.200447 -1.054139
O -1.306480 0.116661 -0.016510
O -8.067616 -0.893716 1.291566
O -8.680805 0.976806 -0.277445
N 4.280379 -0.129010 0.138231
N 6.443001 -0.934781 -0.829278
N 6.376427 0.849299 0.846439
N 4.363891 1.861500 1.525486
N 8.436661 -0.041926 0.068063
C 4.994675 -1.149557 -0.793657
C 4.704874 -2.547252 -0.227587
C 4.444821 -0.981398 -2.216475
C 2.843240 -0.017907 0.071219
C 5.036862 0.831320 0.831730
C 2.058196 -0.911347 0.827662
C 2.238008 0.961389 -0.733460
C 7.037159 -0.075607 -0.017889
C 0.064453 0.162403 -0.062750
C 0.674339 -0.819469 0.753993
C 0.845529 1.056155 -0.803673
C -2.050921 1.062998 -0.841398
C -3.500345 0.740450 -0.590691
C -4.479540 1.512338 -1.238585
C -3.874914 -0.302128 0.267132
C -6.205866 0.187827 -0.172316
C -5.829469 1.232594 -1.025778
C -5.228119 -0.575834 0.475485
H 5.312786 -3.293704 -0.761554
H 4.981573 -2.624093 0.830483
H 3.655861 -2.834151 -0.335459
H 4.996359 -1.641036 -2.903940
H 4.584757 0.038998 -2.590284
H 3.384097 -1.236217 -2.289316
H 2.532292 -1.666650 1.460284
H 2.860117 1.655969 -1.303088
H 0.392910 1.819232 -1.430805
H 4.957424 2.426351 2.131474
H 3.471362 1.634931 1.945488
H -1.795427 2.090516 -0.517601
H -1.772889 0.905449 -1.901656
H 8.947139 -0.475404 -0.690127
H 8.851203 0.803759 0.435805
H -4.194337 2.326311 -1.903458
H -3.102441 -0.896175 0.770592
H -6.595456 1.839703 -1.524448
H -5.519374 -1.387237 1.154453


%chk=000279328-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000279328

0 1
Cl -0.219535 -2.048118 1.803367
S -8.128512 0.087203 -0.000298
F -8.378675 -1.166254 -1.349251
O -1.339220 0.033222 0.041161
O -8.432565 -0.683938 1.375221
O -8.945198 1.393075 -0.458100
N 4.341781 -0.095620 0.033555
N 6.465115 -0.613009 -1.142502
N 6.427369 0.711014 0.925990
N 4.425069 1.298006 1.961901
N 8.362855 0.520823 -0.359629
C 5.111908 -1.106364 -0.857868
C 5.193719 -2.460558 -0.098876
C 4.368484 -1.271292 -2.196876
C 2.906461 -0.037587 0.029600
C 5.093542 0.617849 0.963256
C 2.142771 -0.942758 0.819017
C 2.228326 0.920933 -0.761290
C 7.035312 0.156555 -0.223233
C 0.055268 0.067032 -0.006773
C 0.741820 -0.883912 0.792654
C 0.819276 0.974545 -0.783050
C -2.082283 0.982509 -0.787360
C -3.565479 0.737646 -0.574626
C -4.494811 1.556536 -1.266418
C -4.027301 -0.280583 0.294376
C -6.291622 0.340883 -0.236475
C -5.881599 1.364382 -1.106949
C -5.412362 -0.492278 0.471222
H 5.802028 -3.165835 -0.690895
H 5.684862 -2.321509 0.880762
H 4.192248 -2.904168 0.051242
H 4.960965 -1.956759 -2.824566
H 4.303547 -0.303413 -2.722202
H 3.355735 -1.690570 -2.066480
H 2.648357 -1.683281 1.445354
H 2.816784 1.621260 -1.361418
H 0.323886 1.723685 -1.407231
H 4.993941 1.862747 2.587518
H 3.425840 1.195802 2.114203
H -1.818506 2.022625 -0.501491
H -1.817745 0.838174 -1.856223
H 8.897218 0.162852 -1.145498
H 8.762968 1.173865 0.306800
H -4.141914 2.348550 -1.937303
H -3.300600 -0.901173 0.823656
H -6.612709 1.989329 -1.628486
H -5.788517 -1.270622 1.142213


