%chk=000244707.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244707

0 1
S 0.003806 -1.930223 -1.593006
O -0.007623 0.408646 2.166148
C 0.040861 0.194333 0.732641
C 1.326520 -0.553857 0.401296
C -1.243990 -0.572886 0.460961
C -0.009916 1.553453 0.032726
C 1.394916 -1.517934 -0.606918
C -1.354921 -1.513492 -0.564568
C 2.500389 -0.253670 1.113890
C -2.374714 -0.307622 1.253451
C 0.506126 1.730662 -1.256510
C -0.609868 2.635642 0.694296
C 2.589140 -2.181021 -0.911720
C -2.561234 -2.169265 -0.831812
C 3.699383 -0.902847 0.818892
C -3.583471 -0.956956 0.999361
C 3.745518 -1.867145 -0.196282
C -3.680492 -1.881479 -0.048336
C 0.431627 2.983776 -1.873820
C -0.680183 3.885980 0.076691
C -0.158094 4.062598 -1.209301
H 2.471607 0.494780 1.907647
H -2.291965 0.406214 2.077097
H 0.775546 0.918740 2.468829
H 0.964940 0.897623 -1.790336
H -1.027269 2.492971 1.692719
H 2.620172 -2.939563 -1.695268
H -2.631404 -2.901735 -1.636375
H 4.601371 -0.660212 1.378956
H -4.453861 -0.744019 1.618031
H 4.682019 -2.374604 -0.423965
H -4.626942 -2.381795 -0.247785
H 0.833551 3.115367 -2.877160
H -1.145868 4.722155 0.595040
H -0.214378 5.036586 -1.691709


%chk=000244707-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244707

0 1
S -0.262925 -1.322828 -1.851567
O 0.274038 0.748565 2.196838
C 0.107487 0.316688 0.785134
C 1.302063 -0.564186 0.380425
C -1.190949 -0.499774 0.694356
C 0.031462 1.601250 -0.085063
C 1.262351 -1.304769 -0.826933
C -1.483511 -1.237256 -0.479809
C 2.470788 -0.629045 1.173396
C -2.134337 -0.501872 1.747549
C 1.212511 2.185571 -0.610892
C -1.202828 2.280144 -0.253169
C 2.379890 -2.049768 -1.264582
C -2.709443 -1.924189 -0.623887
C 3.594344 -1.371089 0.747497
C -3.361884 -1.187571 1.615968
C 3.555085 -2.070391 -0.481345
C -3.656664 -1.888347 0.423165
C 1.159611 3.419836 -1.294972
C -1.255219 3.513785 -0.937255
C -0.074310 4.089233 -1.460745
H 2.475939 -0.092410 2.126313
H -1.881952 0.044922 2.659823
H 0.488057 1.715133 2.195166
H 2.170960 1.667742 -0.496617
H -2.122349 1.836501 0.143306
H 2.322591 -2.623756 -2.195441
H -2.910356 -2.496715 -1.535495
H 4.494184 -1.405353 1.371161
H -4.084650 -1.174876 2.438949
H 4.422457 -2.648117 -0.819103
H -4.607315 -2.421668 0.313285
H 2.079159 3.855357 -1.701640
H -2.216698 4.023715 -1.064537
H -0.116289 5.044739 -1.995479


