%chk=000215031.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215031

0 1
Cl 3.524071 -5.297461 -1.060751
S 2.420015 0.169580 1.710571
N -2.751779 -0.073143 -0.353570
N 0.157614 -0.159433 -0.626942
C -4.057574 0.305851 0.307036
C -4.904701 1.150018 -0.674662
C -4.841846 -0.977868 0.668670
C -1.954721 1.138098 -0.745715
C -1.894089 -0.911030 0.551377
C -0.697774 0.693812 -1.519983
C -0.632808 -1.366684 -0.208970
C -6.262549 1.506559 -0.057543
C -6.199476 -0.631594 1.291956
C -7.037297 0.247169 0.353375
C 1.433198 -0.549005 -1.323458
C 2.349252 0.676421 -1.579997
C 2.214209 -1.558229 -0.503028
C 2.209727 1.807499 -0.605496
C 2.732761 -1.267419 0.761754
C 2.467379 -2.820787 -1.070238
C 2.226717 1.646469 0.781111
C 2.070156 3.111908 -1.126517
C 3.506086 -2.210914 1.460703
C 3.224575 -3.748398 -0.359767
C 2.089584 2.752875 1.639031
C 3.753937 -3.464392 0.903334
C 1.943628 4.212225 -0.282885
C 1.948963 4.032308 1.107017
H -3.882754 0.900316 1.240467
H -5.048332 0.581815 -1.614944
H -4.367427 2.074638 -0.957730
H -4.258622 -1.607403 1.366894
H -4.983769 -1.588960 -0.244610
H -1.653402 1.755868 0.129482
H -2.575844 1.780672 -1.406729
H -2.469258 -1.810334 0.862131
H -1.594633 -0.372379 1.478038
H -1.000039 0.170038 -2.453013
H -0.120984 1.597166 -1.810948
H -0.010267 -1.983032 0.475328
H -0.923791 -2.008635 -1.068419
H -6.857409 2.095441 -0.780565
H -6.116358 2.160973 0.823147
H -6.049538 -0.112220 2.257883
H -6.749403 -1.561975 1.527503
H 1.210922 -1.005328 -2.330389
H -7.986888 0.528808 0.844031
H -7.315970 -0.330633 -0.548949
H 2.162068 1.039138 -2.612744
H 3.411961 0.342392 -1.589986
H 2.072422 -3.074426 -2.054314
H 2.062301 3.260928 -2.205019
H 3.921272 -1.970256 2.443387
H 2.093429 2.621383 2.723379
H 4.349537 -4.205047 1.436243
H 1.839343 5.211797 -0.700582
H 1.844878 4.889916 1.768614


%chk=000215031-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215031

0 1
Cl 3.683076 -5.349968 -1.107203
S 2.414386 0.239301 1.856371
N -2.805756 -0.115843 -0.323492
N 0.121889 -0.196625 -0.592447
C -4.131282 0.205961 0.307819
C -4.930319 1.248139 -0.517528
C -4.977047 -1.088135 0.458585
C -2.021311 1.073815 -0.747686
C -1.945641 -0.947596 0.561247
C -0.724797 0.657457 -1.461763
C -0.659209 -1.380971 -0.155140
C -6.335279 1.514540 0.076729
C -6.378220 -0.819532 1.056586
C -7.158756 0.216466 0.219055
C 1.409575 -0.556818 -1.243701
C 2.268697 0.706713 -1.584746
C 2.231613 -1.549802 -0.425714
C 2.239891 1.866521 -0.596484
C 2.772627 -1.252912 0.853565
C 2.535513 -2.805364 -1.008813
C 2.333829 1.759871 0.816607
C 2.148593 3.177482 -1.143130
C 3.574198 -2.208479 1.528670
C 3.326366 -3.741781 -0.321075
C 2.330734 2.924562 1.629976
C 3.852440 -3.466141 0.953405
C 2.148213 4.338653 -0.345094
C 2.237739 4.208132 1.059057
H -3.971098 0.641012 1.333183
H -5.025725 0.870932 -1.556739
H -4.386698 2.209587 -0.564230
H -4.455560 -1.824760 1.096714
H -5.075581 -1.543609 -0.547424
H -1.754578 1.726465 0.122793
H -2.613429 1.673286 -1.458142
H -2.491932 -1.857618 0.859024
H -1.667176 -0.390695 1.492399
H -0.992086 0.120003 -2.408986
H -0.169870 1.573729 -1.726511
H -0.047011 -1.979293 0.541283
H -0.933268 -2.031563 -1.025163
H -6.870015 2.245179 -0.560753
H -6.224910 1.985093 1.076214
H -6.271732 -0.442423 2.095354
H -6.941087 -1.770975 1.119916
H 1.209433 -1.062859 -2.227069
H -8.140300 0.431489 0.684445
H -7.361729 -0.203355 -0.787854
H 1.943109 1.097999 -2.565630
H 3.310393 0.359747 -1.731001
H 2.136385 -3.046562 -1.999272
H 2.078573 3.276009 -2.234120
H 3.995246 -1.961984 2.509029
H 2.407813 2.820029 2.718626
H 4.473478 -4.197098 1.478327
H 2.078668 5.327688 -0.809977
H 2.239627 5.091997 1.705908


