%chk=000296297.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296297

0 1
S 7.727463 -2.799803 -0.590841
C -3.336784 -0.142103 -0.007379
C -2.202453 0.884191 0.116437
C -4.713567 0.531233 0.072259
C -0.825921 0.210356 0.037133
C -5.847820 -0.495076 -0.051985
C 0.308631 1.236467 0.160840
C -7.224799 0.177856 0.028034
C 1.683104 0.560599 0.081147
C -8.358683 -0.848465 -0.096743
C 2.821859 1.585846 0.204458
C -9.736868 -0.176810 -0.016488
C 4.161232 0.906677 0.123305
C -10.869299 -1.193856 -0.140424
C 4.795771 0.447078 1.287232
C 4.786521 0.717414 -1.119423
C 6.037128 -0.186955 1.211587
C 6.026990 0.084003 -1.196802
C 6.663145 -0.373438 -0.031050
C 7.984128 -1.057870 -0.111519
H -3.242664 -0.693835 -0.962610
H -3.244010 -0.903957 0.790517
H -2.297274 1.435959 1.071508
H -2.295611 1.645554 -0.681878
H -4.806726 1.293054 -0.725599
H -4.808279 1.082592 1.027575
H -0.731927 -0.341775 -0.918003
H -0.733553 -0.551510 0.835175
H -5.754917 -1.257279 0.745540
H -5.753703 -1.046339 -1.007451
H 0.213610 1.788391 1.115885
H 0.215137 1.997904 -0.637487
H -7.317849 0.940109 -0.769402
H -7.319324 0.728648 0.983683
H 1.779968 -0.201381 0.879059
H 1.781328 0.008152 -0.873915
H -8.265774 -1.399891 -1.052035
H -8.266944 -1.611628 0.699772
H 2.726704 2.144166 1.157819
H 2.727719 2.353134 -0.590733
H -9.830771 0.585753 -0.814284
H -9.832085 0.373453 0.940034
H -11.848379 -0.705522 -0.082142
H -10.826797 -1.730875 -1.094814
H -10.828196 -1.942985 0.658423
H 4.318743 0.584402 2.256110
H 4.300382 1.064472 -2.029797
H 6.519332 -0.534300 2.123883
H 6.499990 -0.062935 -2.167476
H 8.644759 -0.605981 -0.880014
H 8.545231 -1.014213 0.842128
H 6.616300 -3.063379 0.129251


%chk=000296297-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296297

0 1
S 8.064121 -2.856334 -0.724006
C -3.388372 -0.114470 -0.074419
C -2.227283 0.896681 0.058861
C -4.785117 0.534840 0.049989
C -0.831269 0.241887 -0.044546
C -5.945033 -0.477762 -0.082993
C 0.330278 1.252548 0.088989
C -7.342535 0.167836 0.053276
C 1.723340 0.589531 0.017323
C -8.501564 -0.846101 -0.077639
C 2.886711 1.611957 0.155450
C -9.899583 -0.201611 0.063256
C 4.255009 0.949489 0.117119
C -11.050646 -1.222949 -0.064608
C 4.862186 0.462343 1.302066
C 4.944187 0.759328 -1.110458
C 6.113451 -0.192011 1.263647
C 6.191117 0.103354 -1.153105
C 6.796295 -0.382765 0.035290
C 8.134222 -1.080811 0.004827
H -3.311128 -0.633709 -1.052743
H -3.280046 -0.900042 0.702675
H -2.312363 1.424616 1.031955
H -2.327167 1.675297 -0.726231
H -4.894677 1.321546 -0.725754
H -4.862192 1.052334 1.029357
H -0.745433 -0.288952 -1.015688
H -0.732679 -0.534524 0.742783
H -5.830659 -1.268268 0.688227
H -5.872423 -0.990472 -1.065155
H 0.232973 1.796724 1.052147
H 0.244649 2.018793 -0.710004
H -7.458242 0.958072 -0.718052
H -7.414721 0.680597 1.035547
H 1.815031 -0.172067 0.818047
H 1.831517 0.045215 -0.942606
H -8.432698 -1.357679 -1.060737
H -8.385555 -1.637772 0.692204
H 2.758367 2.163200 1.108127
H 2.800674 2.357152 -0.659958
H -10.015838 0.587723 -0.707432
H -9.966549 0.311148 1.044710
H -12.038563 -0.737411 0.039675
H -11.024506 -1.728354 -1.048640
H -10.974119 -2.004667 0.714785
H 4.354216 0.605072 2.264147
H 4.496934 1.134740 -2.039452
H 6.568863 -0.550195 2.195733
H 6.700665 -0.044554 -2.112840
H 8.852074 -0.579525 -0.665423
H 8.580126 -1.153316 1.009390
H 7.078152 -3.320399 0.131382


