%chk=000266952.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266952

0 1
O 1.587572 -2.112217 -0.328236
O 4.281237 -1.307175 0.204116
O 4.837752 1.576051 -0.041872
O -4.772200 -1.373495 -0.677360
O -1.992627 1.400021 3.482692
O -3.238506 -3.551215 -0.732365
N -0.388495 1.013794 1.908854
C -1.251513 1.478706 0.793878
C -0.686309 2.754249 0.131267
C -1.500886 0.333919 -0.197584
C 0.236646 2.523545 -1.070235
C -0.459382 -0.292036 -0.815589
C 1.302411 1.516694 -0.748992
C 0.944515 0.152599 -0.621138
C -2.916629 0.013503 -0.382396
C 1.956801 -0.779294 -0.320189
C 2.616478 1.927944 -0.543532
C -0.541439 -1.421708 -1.737973
C -3.929731 1.121581 -0.189210
C -3.399675 -1.224286 -0.661810
C 3.298648 -0.381225 -0.131542
C 3.621229 0.988620 -0.231262
C -1.466180 -2.394121 -1.793603
C -0.869294 0.999973 3.222867
C -2.686070 -2.496905 -1.001474
C -3.859855 2.138489 -1.289202
C 0.096121 0.476703 4.249178
C 1.876522 -2.856541 0.889031
C 4.645635 -2.177045 -0.908748
C -4.083932 3.437645 -1.101288
C 5.969188 0.744988 0.332315
H -2.242909 1.777057 1.276953
H -1.544227 3.379639 -0.199239
H -0.157310 3.355594 0.899376
H -0.359515 2.175077 -1.942796
H 0.677546 3.490807 -1.387249
H 0.543443 0.686369 1.676770
H 2.897375 2.978266 -0.619498
H 0.320833 -1.497256 -2.423132
H -3.798021 1.586369 0.819211
H -4.967751 0.701958 -0.160569
H -1.334606 -3.236107 -2.486388
H -3.630917 1.729352 -2.275667
H 0.333599 -0.582936 4.091175
H 1.038655 1.038320 4.267147
H -0.349588 0.559857 5.254722
H -5.015038 -2.351823 -0.634971
H 2.926026 -2.741781 1.183254
H 1.195857 -2.516930 1.674376
H 1.647965 -3.884548 0.584185
H 5.389918 -2.836385 -0.451694
H 3.767423 -2.736429 -1.250128
H 5.073913 -1.584555 -1.720309
H -4.061740 4.162754 -1.901086
H -4.321436 3.877504 -0.143684
H 5.720878 0.121725 1.198989
H 6.726619 1.500008 0.573915
H 6.266177 0.128335 -0.519762


%chk=000266952-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266952

0 1
O 1.762393 -2.146363 0.129291
O 4.349219 -1.225698 0.647837
O 5.013732 1.573913 -0.128623
O -4.783595 -1.178618 -1.404330
O -1.950044 0.930242 3.170057
O -3.684802 -2.808697 -2.898448
N -0.223744 1.239636 1.637992
C -1.139182 1.500041 0.503849
C -0.667955 2.708330 -0.362872
C -1.451304 0.242530 -0.353753
C 0.361150 2.372729 -1.476265
C -0.337726 -0.428234 -0.937249
C 1.432258 1.421466 -0.980184
C 1.061027 0.073598 -0.681829
C -2.855105 -0.100042 -0.481118
C 2.068344 -0.796710 -0.183820
C 2.758303 1.846550 -0.780854
C -0.357493 -1.572292 -1.807704
C -3.909494 0.625064 0.378833
C -3.409472 -1.065731 -1.347700
C 3.412863 -0.372882 0.023257
C 3.764562 0.972810 -0.293985
C -1.399669 -2.281964 -2.391663
C -0.705512 0.985300 2.911258
C -2.809390 -2.080713 -2.256816
C -4.385145 1.939474 -0.224138
C 0.354115 0.786958 3.991002
C 1.148029 -2.335435 1.463344
C 4.720985 -2.445852 -0.107888
C -4.470813 3.115899 0.447455
C 6.246332 0.770452 -0.033820
H -2.065881 1.827142 0.988932
H -1.564559 3.160895 -0.825626
H -0.248105 3.460343 0.333119
H -0.174891 1.909408 -2.326541
H 0.811912 3.309743 -1.848819
H 0.783678 1.266544 1.475988
H 3.055956 2.872605 -1.019012
H 0.640422 -1.927762 -2.087335
H -3.540491 0.769667 1.409923
H -4.789226 -0.039735 0.441715
H -1.134783 -3.107313 -3.063828
H -4.712713 1.885257 -1.273164
H 0.174937 -0.175355 4.500423
H 1.387273 0.803891 3.602915
H 0.245704 1.580852 4.750411
H -4.917656 -1.947243 -2.087802
H 1.855321 -2.021977 2.254225
H 0.205689 -1.762866 1.542560
H 0.940482 -3.412879 1.544572
H 5.414032 -2.993822 0.548723
H 3.825511 -3.052719 -0.319419
H 5.231833 -2.170830 -1.051823
H -4.866241 4.020011 -0.029568
H -4.170074 3.199881 1.499817
H 6.279826 0.199249 0.906316
H 7.056686 1.514671 -0.072454
H 6.333692 0.078587 -0.892866


