%chk=000255990.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255990

0 1
S 0.464860 1.523136 0.263040
O -2.221763 2.050771 -1.229169
C -2.442383 -1.312385 -0.158717
C -3.080330 0.117657 0.063751
C -1.049907 -0.875145 0.458591
C -2.822044 0.376203 1.578961
C -1.471579 -0.336568 1.851726
C -0.675711 0.318918 -0.450780
C -2.031808 1.022629 -0.643580
C -3.127631 -2.437962 0.613981
C -2.366046 -1.729865 -1.629541
C -4.496382 0.333030 -0.399205
C 2.029499 0.743981 0.039371
C 2.834996 1.145444 -1.028470
C 2.472447 -0.207793 0.960022
C 4.105400 0.583736 -1.177186
C 3.741677 -0.770642 0.807131
C 4.565352 -0.378442 -0.262108
C 5.929240 -0.967935 -0.414706
H -0.288608 -1.661739 0.494034
H -3.637315 -0.035412 2.192188
H -2.776831 1.452650 1.807486
H -0.725712 0.346639 2.288412
H -1.585824 -1.160856 2.572939
H -0.273280 -0.028921 -1.428193
H -2.568437 -3.375747 0.519524
H -3.226047 -2.228512 1.684221
H -4.140099 -2.615512 0.232335
H -1.662153 -2.558825 -1.765736
H -3.343999 -2.070496 -1.992235
H -2.054612 -0.925705 -2.303500
H -4.614166 0.095055 -1.464290
H -5.204665 -0.289243 0.159563
H -4.799544 1.382660 -0.274112
H 2.481047 1.893346 -1.740794
H 1.838536 -0.509700 1.794553
H 4.739878 0.895600 -2.004283
H 4.094141 -1.511221 1.521683
H 6.674270 -0.364820 0.126843
H 5.991414 -1.990013 -0.017800
H 6.251518 -1.011797 -1.463847


%chk=000255990-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255990

0 1
S 0.518136 1.677725 0.618961
O -2.273337 2.196953 -1.060699
C -2.393961 -1.276530 -0.172628
C -3.132438 0.111557 0.026357
C -1.094765 -0.814855 0.605381
C -3.025869 0.312630 1.591158
C -1.660322 -0.352956 1.978922
C -0.689399 0.451812 -0.199495
C -2.067762 1.094045 -0.505866
C -3.110591 -2.473530 0.493334
C -2.159164 -1.642283 -1.660774
C -4.528590 0.313067 -0.554741
C 2.104700 0.810554 0.233791
C 2.696995 0.949700 -1.043536
C 2.753750 0.041469 1.226938
C 3.925742 0.311968 -1.323760
C 3.988522 -0.584039 0.939632
C 4.594192 -0.460536 -0.337583
C 5.935570 -1.109106 -0.632551
H -0.292147 -1.567968 0.663907
H -3.886132 -0.184176 2.075216
H -3.071934 1.382012 1.863647
H -0.971768 0.356624 2.468116
H -1.800068 -1.209356 2.660248
H -0.199268 0.186020 -1.152441
H -2.475057 -3.377250 0.429116
H -3.348927 -2.307655 1.556436
H -4.057382 -2.697347 -0.032824
H -1.432735 -2.472408 -1.744477
H -3.104629 -1.982076 -2.122117
H -1.785580 -0.802443 -2.272377
H -4.546690 0.129410 -1.644388
H -5.261080 -0.361336 -0.074584
H -4.862325 1.354358 -0.397805
H 2.202859 1.562714 -1.805315
H 2.293605 -0.064883 2.215028
H 4.375996 0.424630 -2.317611
H 4.485039 -1.177358 1.717137
H 6.768734 -0.416457 -0.403209
H 6.089192 -2.018378 -0.025362
H 6.026286 -1.388124 -1.697079


