%chk=000249759.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249759

0 1
O -2.737750 1.150159 -0.073025
O 3.060389 2.659722 0.539652
O 0.687317 -1.305794 0.249963
N 1.581775 0.845382 0.508289
C 0.346272 1.582715 0.869092
C -0.535061 1.869520 -0.352972
C 3.809133 0.379072 -0.014955
C 3.077942 -0.839549 -0.095210
C 2.867324 1.485922 0.365131
C 1.635214 -0.563521 0.224308
C -1.481811 0.722256 -0.692689
C 5.163683 0.417388 -0.262660
C 3.698777 -2.024834 -0.422700
C 5.804711 -0.799167 -0.600861
C 5.091099 -1.989004 -0.678525
C -3.809160 0.288895 -0.103686
C -3.799029 -0.998043 -0.655589
C -4.966358 0.835285 0.492036
C -4.979289 -1.748982 -0.605849
C -6.122654 0.063861 0.525018
C -6.135741 -1.228253 -0.023143
H 0.650798 2.541174 1.354617
H -0.216472 0.989229 1.627819
H -1.148341 2.779403 -0.147908
H 0.084919 2.130061 -1.232861
H -1.657261 0.619782 -1.776021
H -1.173360 -0.247982 -0.256119
H 5.727959 1.349000 -0.201533
H 3.142552 -2.961277 -0.483715
H 6.877512 -0.791498 -0.801347
H 5.602915 -2.916870 -0.939784
H -2.906527 -1.419821 -1.103944
H -4.931274 1.837385 0.909698
H -4.989065 -2.753514 -1.028716
H -7.027304 0.466179 0.980592
H -7.045834 -1.820180 0.008998


%chk=000249759-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249759

0 1
O -2.376892 1.198605 0.180704
O 2.715501 2.521008 -0.880619
O 0.547957 -0.586568 1.922157
N 1.359352 1.196138 0.560244
C 0.341628 2.209461 0.893318
C -0.509466 2.634280 -0.325168
C 3.252108 0.153630 -0.316918
C 2.599285 -0.781138 0.522632
C 2.474091 1.434812 -0.294110
C 1.385259 -0.125660 1.109959
C -1.397738 1.516931 -0.872479
C 4.429986 -0.176423 -1.003396
C 3.101318 -2.078367 0.703943
C 4.946103 -1.487212 -0.828365
C 4.291765 -2.423671 0.011967
C -3.304429 0.173255 -0.069845
C -3.385067 -0.552314 -1.284856
C -4.199226 -0.108217 0.992685
C -4.369589 -1.559131 -1.424358
C -5.173468 -1.113108 0.837095
C -5.266541 -1.845755 -0.372729
H 0.853859 3.095573 1.309909
H -0.301560 1.765296 1.672231
H -1.153647 3.476840 -0.011971
H 0.152709 3.003934 -1.129016
H -1.927177 1.854192 -1.786831
H -0.804726 0.611546 -1.119076
H 4.927155 0.555534 -1.647570
H 2.588140 -2.791535 1.356505
H 5.863930 -1.782181 -1.348175
H 4.714005 -3.427606 0.127844
H -2.701205 -0.348239 -2.114131
H -4.108663 0.464007 1.921098
H -4.430455 -2.119503 -2.364415
H -5.861181 -1.327536 1.662830
H -6.025119 -2.626778 -0.489691


