%chk=000248236.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248236

0 1
S -2.672865 -2.075310 1.453265
C 1.143155 0.553544 -0.005939
C 0.217505 -0.545717 -0.043558
C -1.161343 -0.297610 -0.048625
C -1.660337 1.037359 -0.033990
C 2.583747 0.276313 0.005821
C -0.735416 2.119416 0.002366
C 0.652766 1.853795 0.018517
C 3.039059 -1.062018 -0.025927
C 0.744868 -1.902873 -0.079312
C -2.108288 -1.406135 -0.065633
C 2.073619 -2.147382 -0.070994
C -3.068109 1.336993 -0.058678
C 3.541277 1.318106 0.048695
C -1.233006 3.470108 0.020737
C 4.427310 -1.335594 -0.014269
C -3.509251 2.630681 -0.042175
C -2.576850 3.716707 -0.000342
C 4.898345 1.036578 0.059685
C -2.683322 -2.067201 -1.108860
C 5.345785 -0.299023 0.028049
C -3.583899 -3.119711 -0.692034
C -3.684857 -3.248321 0.657955
H 1.345332 2.697893 0.049544
H 0.025513 -2.724025 -0.115379
H 2.461635 -3.165703 -0.097787
H -3.776558 0.507796 -0.092261
H 3.202715 2.355089 0.073724
H -0.511549 4.285061 0.051609
H 4.767367 -2.369903 -0.038571
H -4.573429 2.860966 -0.060285
H -2.964330 4.734161 0.013759
H -2.503320 -1.848729 -2.152960
H 5.626484 1.845319 0.093033
H 6.414120 -0.508343 0.037244
H -4.110858 -3.727713 -1.415411
H -4.278417 -3.944475 1.223990


%chk=000248236-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248236

0 1
S -2.633755 -2.242644 1.514335
C 1.168474 0.573723 -0.004346
C 0.229586 -0.541282 -0.020896
C -1.176515 -0.300544 -0.032364
C -1.683155 1.042114 -0.028587
C 2.617029 0.298741 0.008697
C -0.742121 2.149357 -0.016888
C 0.652654 1.883819 -0.003428
C 3.074069 -1.066336 -0.000371
C 0.750580 -1.895865 -0.035088
C -2.129027 -1.438803 -0.046375
C 2.105447 -2.144579 -0.024754
C -3.091673 1.339057 -0.032779
C 3.601265 1.331790 0.029918
C -1.245338 3.497215 -0.015751
C 4.472526 -1.349532 0.012309
C -3.545699 2.656595 -0.029045
C -2.614743 3.749263 -0.022317
C 4.973881 1.036404 0.042333
C -2.778640 -2.039591 -1.115712
C 5.417505 -0.314729 0.033566
C -3.662646 -3.122773 -0.750907
C -3.702481 -3.363241 0.611851
H 1.329994 2.744154 0.008280
H 0.035703 -2.723597 -0.058520
H 2.479118 -3.175510 -0.035961
H -3.804103 0.508203 -0.038553
H 3.294555 2.382142 0.037725
H -0.527859 4.326406 -0.008646
H 4.798861 -2.396302 0.005245
H -4.621230 2.865257 -0.030231
H -2.987990 4.779129 -0.020488
H -2.620710 -1.709670 -2.145811
H 5.705652 1.851444 0.059130
H 6.489009 -0.541610 0.043536
H -4.241763 -3.698341 -1.477262
H -4.271862 -4.109765 1.163161


