%chk=000256520.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256520

0 1
O 5.175460 0.576860 1.310549
O -3.035041 -1.169817 2.021919
O 3.171523 1.372599 1.885013
O -3.755070 0.928798 1.898634
C 1.173317 -1.126386 -0.611234
C 0.583837 0.234274 -1.097854
C -0.781399 0.633668 -0.436463
C -1.758045 -0.572707 -0.635223
C 2.371617 -1.450929 -1.556771
C 3.435286 -0.462440 -1.036971
C 0.119751 -2.244170 -0.660648
C 1.864679 -1.037466 0.781282
C 1.634767 1.358770 -0.971087
C -1.184254 -1.835414 0.027177
C 3.344371 -0.678896 0.506483
C 3.032964 0.959041 -1.470512
C -3.225389 -0.274928 -0.215358
C -1.359183 1.850131 -1.213435
C -0.615277 1.014198 1.039626
C -3.730588 0.988188 -0.955231
C -2.790260 2.183638 -0.783441
C -4.148323 -1.455578 -0.566140
C 3.794447 0.521893 1.293147
C -3.368369 -0.043426 1.291099
H 0.372008 0.100566 -2.190339
H -1.807704 -0.764362 -1.740399
H 2.133753 -1.300477 -2.618558
H 2.699402 -2.496479 -1.455120
H 4.454805 -0.698201 -1.401338
H 0.517152 -3.165136 -0.193742
H -0.083503 -2.515647 -1.715106
H 1.794318 -1.995532 1.320114
H 1.377722 -0.287891 1.430454
H 1.699701 1.680461 0.093887
H 1.293552 2.251355 -1.527982
H -1.914031 -2.666207 -0.016797
H -1.014353 -1.655592 1.110003
H 4.004580 -1.538500 0.782901
H 3.066410 1.016589 -2.575709
H 3.777368 1.695012 -1.112393
H -1.333371 1.651399 -2.300633
H -0.713114 2.734073 -1.051580
H -0.544273 0.128798 1.683675
H 0.299436 1.606365 1.201642
H -1.447544 1.628475 1.407356
H -4.741005 1.258927 -0.588800
H -3.847427 0.752792 -2.030378
H -3.168928 3.044276 -1.365944
H -2.801035 2.510575 0.280386
H -3.874404 -2.357083 0.001973
H -5.197935 -1.234606 -0.341291
H -4.087462 -1.708234 -1.630275
H 5.522814 1.353877 1.820684
H -3.150849 -1.029293 2.998447


%chk=000256520-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256520

0 1
O 5.496012 0.419692 1.094323
O -3.244992 -1.126196 2.098943
O 3.526922 1.272036 1.965258
O -4.210391 0.939346 1.765570
C 1.206014 -1.105793 -0.559681
C 0.580693 0.269918 -1.001217
C -0.808665 0.661480 -0.333630
C -1.774401 -0.571365 -0.530442
C 2.370414 -1.427363 -1.546799
C 3.467555 -0.436032 -1.106144
C 0.141897 -2.226314 -0.600864
C 1.977105 -1.006475 0.807752
C 1.650519 1.396724 -0.910718
C -1.182020 -1.856634 0.096258
C 3.468052 -0.702119 0.448457
C 3.029290 0.994969 -1.504238
C -3.299430 -0.289906 -0.208386
C -1.381337 1.876905 -1.135859
C -0.684243 1.064498 1.163635
C -3.759463 0.950617 -1.029940
C -2.863139 2.189182 -0.834845
C -4.169564 -1.512285 -0.646406
C 4.097345 0.416210 1.250270
C -3.617590 -0.048956 1.272942
H 0.335175 0.135516 -2.081387
H -1.796914 -0.751288 -1.632609
H 2.077562 -1.295481 -2.605139
H 2.704340 -2.476535 -1.413038
H 4.461290 -0.657939 -1.534812
H 0.565402 -3.148994 -0.153919
H -0.076420 -2.464352 -1.664550
H 1.905034 -1.967719 1.350138
H 1.578545 -0.225403 1.471680
H 1.797222 1.683423 0.145602
H 1.291321 2.302813 -1.433022
H -1.891250 -2.696695 -0.012721
H -1.028463 -1.731101 1.182018
H 4.097843 -1.596749 0.612957
H 2.988693 1.031604 -2.611866
H 3.790705 1.737930 -1.194287
H -1.275398 1.663308 -2.221593
H -0.771793 2.777132 -0.928260
H -0.503014 0.199776 1.823434
H 0.140547 1.781276 1.319080
H -1.602847 1.560851 1.519603
H -4.804410 1.196838 -0.765228
H -3.750782 0.656065 -2.099880
H -3.208230 2.998142 -1.508228
H -2.987059 2.570770 0.194678
H -4.004004 -2.394130 -0.007725
H -5.243262 -1.251946 -0.601169
H -3.926794 -1.779125 -1.691795
H 5.876129 1.178658 1.615501
H -3.518849 -0.908586 3.031997


