%chk=000231773.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231773

0 1
Cl -1.090865 -4.483423 0.949010
S -1.739025 0.392513 -1.731680
S 2.985980 1.088193 1.723621
O -1.415543 1.569603 -2.507115
O -1.765190 -0.917005 -2.335077
O 3.180862 2.489850 2.031964
O 3.474806 0.078269 2.639129
N -0.517160 0.413851 -0.501808
N 1.262123 0.936726 1.617639
C -0.187594 -0.631004 0.379771
C 0.693540 -0.381418 1.482725
C -3.193756 0.651586 -0.846182
C 3.503824 0.732987 0.121156
C -0.720303 -1.924951 0.216992
C 0.987172 -1.405431 2.391587
C -0.407830 -2.907708 1.152200
C 0.433455 -2.679033 2.239674
C -3.670371 1.955501 -0.665444
C -3.903342 -0.433483 -0.320271
C 3.675418 1.772370 -0.800145
C 3.750304 -0.591377 -0.257430
C -4.849620 2.175316 0.050754
C -5.082910 -0.214745 0.397337
C 4.084287 1.486240 -2.105295
C 4.158671 -0.878152 -1.563044
C -5.553938 1.089378 0.583818
C 4.322129 0.160544 -2.486366
H 0.092012 1.249421 -0.431834
H 0.686623 1.554264 2.207817
H -1.326602 -2.184399 -0.659843
H 1.676642 -1.213056 3.225586
H 0.661465 -3.470467 2.951404
H -3.125720 2.805428 -1.092942
H -3.544386 -1.457663 -0.473388
H 3.496872 2.810931 -0.498793
H 3.630305 -1.404726 0.466876
H -5.221116 3.189833 0.191346
H -5.634228 -1.060075 0.808612
H 4.214760 2.293604 -2.825144
H 4.346163 -1.909360 -1.860931
H -6.474586 1.260542 1.144395
H 4.635970 -0.063674 -3.507281


%chk=000231773-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231773

0 1
Cl -2.273372 -3.551175 3.185433
S -0.964843 0.405906 -1.046392
S 3.564657 -0.111096 1.116828
O -0.518644 1.780140 -1.791768
O -0.445176 -1.055140 -1.555675
O 4.824804 0.586671 1.889085
O 3.373619 -1.729789 1.066743
N -0.493249 0.749770 0.780789
N 1.904173 0.690227 2.124212
C -0.262797 -0.317914 1.667645
C 0.960981 -0.320984 2.433929
C -2.847708 0.317242 -0.968046
C 3.475303 0.572541 -0.633205
C -1.248209 -1.308735 1.910123
C 1.149120 -1.319731 3.430043
C -1.003703 -2.282226 2.889531
C 0.176093 -2.307116 3.667369
C -3.558459 1.517294 -0.808901
C -3.445288 -0.943208 -1.127203
C 4.201838 1.744403 -0.903394
C 2.702202 -0.121904 -1.577181
C -4.970051 1.436836 -0.789209
C -4.858558 -0.999003 -1.106452
C 4.144974 2.249381 -2.222310
C 2.652324 0.411876 -2.885792
C -5.614066 0.184513 -0.933579
C 3.369847 1.587830 -3.204619
H 0.323953 1.397027 0.743828
H 2.467868 0.984539 2.947915
H -2.195572 -1.293549 1.366379
H 2.083477 -1.332860 4.002013
H 0.330417 -3.084336 4.419889
H -3.034940 2.473583 -0.715336
H -2.828945 -1.835198 -1.281091
H 4.799038 2.223439 -0.121194
H 2.156937 -1.034075 -1.317422
H -5.561431 2.349507 -0.664314
H -5.362424 -1.963153 -1.228064
H 4.701301 3.157343 -2.477086
H 2.040339 -0.089071 -3.641462
H -6.707874 0.132298 -0.918005
H 3.321343 1.993699 -4.220656


