%chk=000208697.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208697

0 1
Cl -0.516995 -4.447173 -1.927344
S 2.132683 -0.115044 1.723292
O -4.693031 1.500261 1.402628
O 3.340462 -0.719853 2.355963
N -1.787089 0.395446 -0.187398
N -4.648608 0.898533 0.255523
C -0.311138 0.382289 0.137434
C -2.561851 -0.368667 0.854493
C -2.354778 1.785883 -0.250001
C -4.018151 -0.501897 0.387908
C -3.802434 1.700273 -0.754097
C 0.478376 1.263941 -0.853118
C 0.232817 -1.034163 0.000713
C -6.056097 0.739863 -0.316911
C 1.925447 1.556419 -0.550864
C 1.405833 -1.366414 0.686246
C 2.721120 0.989147 0.444502
C -0.358379 -1.994297 -0.832455
C 2.521998 2.504379 -1.417164
C 1.978124 -2.632666 0.598931
C 0.223497 -3.261206 -0.911361
C 4.076515 1.329964 0.563645
C 1.378104 -3.607304 -0.205841
C 3.863286 2.853624 -1.291197
C 4.652657 2.260898 -0.296600
H -0.158096 0.770323 1.183181
H -2.545998 0.130658 1.854191
H -2.124330 -1.381354 0.982459
H -1.754071 2.401683 -0.956112
H -2.345948 2.302831 0.741059
H -4.075866 -1.039900 -0.578021
H -4.597421 -1.073250 1.144123
H -4.229570 2.722242 -0.830588
H -3.846261 1.224129 -1.752596
H -0.055378 2.237739 -0.976496
H 0.424305 0.786955 -1.862357
H -6.066643 0.238035 -1.288773
H -6.680108 0.176503 0.396486
H -6.529546 1.731311 -0.406679
H -1.252459 -1.749587 -1.411276
H 1.925578 2.965917 -2.202714
H 2.896140 -2.858695 1.155740
H 4.690980 0.848772 1.338233
H 1.805715 -4.605806 -0.286626
H 4.302268 3.585682 -1.968964
H 5.704243 2.523080 -0.200198


%chk=000208697-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208697

0 1
Cl -0.299340 -4.298883 -2.272042
S 2.096150 -0.047590 1.980647
O -4.707960 1.569840 1.431378
O 3.472516 -0.791523 2.570847
N -1.824981 0.445320 -0.161341
N -4.716832 0.832394 0.206146
C -0.375758 0.468746 0.199573
C -2.600676 -0.317451 0.864687
C -2.467630 1.772811 -0.378505
C -4.041512 -0.538149 0.410327
C -3.907814 1.588167 -0.863222
C 0.409946 1.525003 -0.627241
C 0.229439 -0.928705 0.016235
C -6.147142 0.642307 -0.260542
C 1.934860 1.610394 -0.480923
C 1.360750 -1.307383 0.765601
C 2.754104 1.058871 0.533066
C -0.269141 -1.857824 -0.928213
C 2.615367 2.373614 -1.472775
C 1.994253 -2.550512 0.648032
C 0.363933 -3.108210 -1.056000
C 4.148127 1.231000 0.584968
C 1.483605 -3.481741 -0.285122
C 4.010031 2.576756 -1.440485
C 4.786573 2.002871 -0.408277
H -0.262103 0.747119 1.280995
H -2.630466 0.224761 1.836982
H -2.125899 -1.301599 1.019217
H -1.930120 2.329002 -1.163708
H -2.501059 2.385792 0.551070
H -4.083022 -1.111114 -0.535127
H -4.620959 -1.043327 1.199066
H -4.400958 2.566846 -0.975224
H -3.938161 1.021892 -1.813552
H 0.012422 2.525727 -0.369108
H 0.180311 1.353415 -1.697170
H -6.195644 0.075958 -1.209460
H -6.678794 0.111344 0.542490
H -6.583871 1.645042 -0.376385
H -1.142564 -1.584979 -1.527359
H 2.025934 2.811558 -2.288300
H 2.875196 -2.759230 1.267380
H 4.703255 0.726647 1.386998
H 1.944225 -4.465588 -0.410656
H 4.489633 3.173398 -2.224042
H 5.871682 2.146717 -0.379930


