%chk=000227452.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227452

0 1
O 0.087520 0.116374 0.103791
O 4.370750 -2.099164 0.333961
O 1.446561 2.596169 -0.348666
O 4.151342 2.601327 -0.137018
O 1.135530 -3.254474 0.472083
O -6.203495 1.302667 -0.046776
C 2.126891 -1.042316 0.223758
C 1.469283 0.224203 0.085077
C 1.079372 -2.053905 0.336795
C 3.528000 -1.046259 0.222286
C 2.132123 1.432728 -0.065938
C -0.214287 -1.270911 0.251831
C 3.567105 1.377498 -0.039219
C 4.247329 0.170015 0.098834
C -1.476506 -1.715753 0.299447
C -2.704778 -0.935821 0.211118
C -3.932371 -1.576601 0.466454
C -2.706131 0.436582 -0.126598
C -5.139667 -0.881013 0.397835
C -3.894601 1.148750 -0.204056
C -5.107899 0.479822 0.062161
C 3.842899 -3.448459 0.465637
C 1.405279 3.527430 0.770389
C 5.604087 2.667598 -0.157539
C -7.511455 0.730334 0.197693
H 5.332325 0.117771 0.110657
H -1.608518 -2.804405 0.423682
H -3.947395 -2.636435 0.726012
H -1.758890 0.948448 -0.335396
H -6.073044 -1.394058 0.601101
H -3.910465 2.205041 -0.465214
H 4.762773 -4.041273 0.520482
H 3.241653 -3.706371 -0.413198
H 3.246294 -3.532258 1.380796
H 0.905826 3.069316 1.626332
H 0.813245 4.349430 0.353810
H 2.420859 3.851819 1.016388
H 5.770767 3.747757 -0.264781
H 5.994936 2.121682 -1.021573
H 6.012884 2.292616 0.785011
H -7.581423 0.368146 1.227219
H -7.723322 -0.058171 -0.529962
H -8.167187 1.597024 0.040197


%chk=000227452-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227452

0 1
O 0.114746 0.235839 0.155338
O 4.335191 -2.184524 0.587694
O 1.526560 2.665477 -0.329574
O 4.342571 2.586396 -0.152558
O 1.003625 -3.171357 0.934201
O -6.480568 1.176352 -0.120318
C 2.119398 -0.993119 0.370531
C 1.527526 0.289532 0.150148
C 1.002670 -1.937525 0.609738
C 3.545729 -1.057549 0.393816
C 2.223521 1.489217 -0.024703
C -0.234244 -1.119480 0.430829
C 3.653346 1.386206 0.033739
C 4.287941 0.139794 0.239731
C -1.524738 -1.567922 0.522142
C -2.777837 -0.848658 0.354278
C -4.000528 -1.563746 0.518716
C -2.857149 0.546145 0.029034
C -5.253173 -0.939439 0.372937
C -4.098517 1.176982 -0.119186
C -5.302858 0.442090 0.051853
C 3.871406 -3.506409 0.104200
C 1.681578 3.783167 0.629167
C 5.810358 2.541924 -0.158194
C -7.756861 0.470689 0.037034
H 5.376357 0.049880 0.254839
H -1.582440 -2.639685 0.759412
H -3.962647 -2.631517 0.766991
H -1.936337 1.118617 -0.106940
H -6.168118 -1.523475 0.507504
H -4.169136 2.239824 -0.369559
H 4.686376 -4.196077 0.369706
H 3.745813 -3.473844 -0.994788
H 2.921509 -3.795456 0.583925
H 1.348863 3.475495 1.638926
H 1.025915 4.578918 0.244713
H 2.728875 4.129031 0.659570
H 6.124988 3.581765 -0.327225
H 6.182445 1.898724 -0.977368
H 6.203272 2.181434 0.811118
H -7.864760 0.060567 1.059610
H -7.857722 -0.344584 -0.705001
H -8.528746 1.233197 -0.141122


