%chk=000116112.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000116112

0 1
Cl -6.232067 -1.404890 -1.258071
S 4.055749 -0.565258 -0.027170
N -3.535885 -0.354854 0.599332
C -1.386527 -1.524052 0.139137
C 1.584523 -1.665176 -0.028966
C -0.629967 -2.853691 0.337018
C -0.495063 -0.338158 0.551963
C 0.689366 -2.855038 -0.445716
C 0.825529 -0.337881 -0.226342
C -2.699659 -1.543903 0.955283
C 2.883571 -1.697440 -0.842708
C -4.870080 -0.407060 1.279278
C 5.545156 -0.746346 -1.067633
C -5.828476 0.531973 0.594066
C 6.547702 0.173239 -0.451578
C -6.512197 0.158268 -0.572204
C -6.060761 1.817020 1.107552
C 7.411011 -0.293389 0.553255
C 6.632979 1.510379 -0.872963
C -7.415497 1.008346 -1.212509
C -6.960592 2.682243 0.478705
C -7.639603 2.279723 -0.676494
C 8.351260 0.568240 1.123620
C 7.575626 2.366390 -0.298173
C 8.437409 1.897867 0.698704
H -1.635592 -1.418783 -0.945284
H 1.823589 -1.779431 1.059213
H -1.257069 -3.703224 0.009600
H -0.427360 -3.017185 1.412656
H -0.295615 -0.372359 1.639404
H -1.039752 0.611887 0.381711
H 1.221811 -3.808500 -0.273380
H 0.481225 -2.809067 -1.531240
H 0.630560 -0.165746 -1.301264
H 1.450636 0.513945 0.105526
H -3.228454 -2.508277 0.792112
H -2.472465 -1.486253 2.042402
H 2.713951 -1.385833 -1.887937
H 3.309895 -2.715979 -0.870602
H -3.670709 -0.323620 -0.419539
H -5.308121 -1.431497 1.327916
H -4.705946 -0.096464 2.338391
H 5.887178 -1.797925 -1.072613
H 5.318263 -0.478441 -2.116275
H -5.524494 2.143220 1.999485
H 7.342493 -1.324431 0.895626
H 5.958492 1.884116 -1.641343
H -7.933927 0.685732 -2.115033
H -7.130794 3.676909 0.889396
H -8.341006 2.956552 -1.162388
H 9.017143 0.202602 1.903503
H 7.636830 3.402579 -0.626674
H 9.170430 2.566522 1.144443


%chk=000116112-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116112

0 1
Cl -8.241243 -1.060095 1.150024
S 3.937256 -0.114280 0.059332
N -3.790887 -0.843594 0.061741
C -1.481954 -1.786250 -0.137175
C 1.528466 -1.625397 -0.016943
C -0.611748 -3.036670 0.144322
C -0.747807 -0.508375 0.337563
C 0.793970 -2.910792 -0.488164
C 0.652917 -0.377561 -0.301203
C -2.881248 -1.926218 0.500869
C 2.918288 -1.542837 -0.675114
C -5.127415 -0.874860 0.688053
C 5.634883 -0.587942 -0.691962
C -5.940635 0.379914 0.386819
C 6.705140 0.352121 -0.191170
C -7.344909 0.429181 0.549133
C -5.309305 1.570840 -0.058444
C 7.371990 0.098409 1.035764
C 7.055756 1.510598 -0.931256
C -8.110418 1.580371 0.285401
C -6.049639 2.741439 -0.332105
C -7.452943 2.748639 -0.163382
C 8.370795 0.977644 1.508879
C 8.054212 2.392532 -0.460385
C 8.715900 2.127983 0.761168
H -1.613957 -1.713805 -1.242102
H 1.673136 -1.700612 1.082581
H -1.115816 -3.946258 -0.239594
H -0.509749 -3.165697 1.242793
H -0.643314 -0.550368 1.442910
H -1.366641 0.379529 0.113028
H 1.400596 -3.804291 -0.239044
H 0.696312 -2.886090 -1.594516
H 0.552248 -0.255659 -1.401206
H 1.158187 0.533270 0.072987
H -3.286254 -2.945253 0.271443
H -2.786917 -1.863191 1.604388
H 2.829905 -1.382721 -1.766102
H 3.488332 -2.473409 -0.492908
H -3.861314 -0.814455 -0.966344
H -5.728403 -1.771013 0.403379
H -4.981679 -0.952726 1.785229
H 5.834869 -1.630457 -0.388702
H 5.531938 -0.540219 -1.789356
H -4.220474 1.544815 -0.169869
H 7.101518 -0.789021 1.620682
H 6.541669 1.721064 -1.876936
H -9.194737 1.563407 0.428191
H -5.533041 3.645389 -0.672574
H -8.037266 3.650609 -0.374288
H 8.878863 0.767263 2.456800
H 8.315771 3.282320 -1.044155
H 9.491496 2.810382 1.126719


