%chk=000252844.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252844

0 1
S 0.611731 3.862547 -0.035826
O -2.291072 -1.340930 -0.532975
O 1.287955 -1.506847 -1.157895
O 3.189520 3.347807 -0.186017
O -2.366692 0.333386 0.996002
O 0.636144 -1.884437 0.983602
C 0.264140 1.220179 0.293642
C -0.344268 -0.054756 -0.344837
C 1.730190 1.402716 -0.135350
C -0.545184 2.463332 -0.094030
C 2.105826 2.854979 -0.132556
C -1.759625 -0.288984 0.161231
C 0.540556 -1.252150 -0.036419
C -3.657196 -1.768948 -0.204645
C 2.261937 -2.603233 -1.105919
C -4.657582 -0.808893 -0.808345
C 3.490400 -2.164188 -0.340258
H 0.224605 1.099465 1.410826
H -0.394145 0.070135 -1.465861
H 2.413984 0.833873 0.532085
H 1.918111 0.979357 -1.150390
H -1.383289 2.634557 0.613427
H -0.988032 2.396259 -1.103862
H -3.668523 -2.770805 -0.673277
H -3.741931 -1.845174 0.894063
H 1.769899 -3.485163 -0.658360
H 2.447686 -2.759375 -2.184890
H -5.683221 -1.186951 -0.710298
H -4.622987 0.172219 -0.310493
H -4.467427 -0.640592 -1.876226
H 4.290110 -2.913680 -0.406065
H 3.895438 -1.218532 -0.722470
H 3.268844 -2.021972 0.728389


%chk=000252844-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252844

0 1
S 0.613714 4.047501 0.333081
O -2.276595 -1.346631 -0.513363
O 1.225408 -1.591287 -1.200754
O 3.300011 3.413929 0.341887
O -2.378000 0.426718 0.999090
O 0.663980 -1.726887 1.064182
C 0.272033 1.311252 0.292827
C -0.331109 0.036881 -0.361723
C 1.746070 1.533045 -0.110354
C -0.508523 2.588810 -0.108163
C 2.144065 2.978929 0.203303
C -1.759090 -0.235860 0.138396
C 0.545633 -1.186399 -0.057505
C -3.660999 -1.776289 -0.124056
C 2.163356 -2.754235 -1.045876
C -4.711006 -1.021148 -0.942021
C 3.535060 -2.285284 -0.555715
H 0.208722 1.199557 1.391101
H -0.366584 0.150659 -1.461065
H 2.447133 0.857184 0.408243
H 1.884715 1.377905 -1.200623
H -1.446115 2.687911 0.454160
H -0.706540 2.629172 -1.193355
H -3.661130 -2.856115 -0.339847
H -3.785567 -1.602003 0.958743
H 1.706790 -3.474862 -0.345256
H 2.205500 -3.180361 -2.060424
H -5.716950 -1.412460 -0.702083
H -4.697765 0.055682 -0.704277
H -4.539855 -1.153805 -2.024135
H 4.236045 -3.140235 -0.548086
H 3.949938 -1.508797 -1.221377
H 3.473560 -1.887273 0.471047


