%chk=000194319.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194319

0 1
O 3.274078 1.996118 -0.653527
O 4.569531 -0.508240 -0.795671
N -0.054420 1.280832 0.174054
N 2.299381 -0.102474 -0.525369
N 4.396287 -3.237891 -0.239281
C 0.855948 1.912334 -0.836542
C 0.861571 3.438372 -0.590590
C 0.051709 3.679590 0.693784
C -0.248115 2.285489 1.276706
C -1.310958 0.782472 -0.371859
C 2.275196 1.321017 -0.645589
C -1.746261 -0.499921 0.125955
C -2.049934 1.454717 -1.322433
C -2.935621 -1.061129 -0.409217
C -1.030985 -1.224298 1.131763
C -3.240100 0.877949 -1.846016
C -3.672712 -0.347249 -1.407236
C -3.379536 -2.338506 0.061796
C -1.479475 -2.446416 1.566301
C 3.466036 -0.921708 -0.536898
C -2.668801 -3.012691 1.022369
C 3.181487 -2.395449 -0.217166
H 0.550735 1.675394 -1.886944
H 0.427918 3.976657 -1.449082
H 1.900064 3.818928 -0.487153
H 0.615183 4.298788 1.412881
H -0.880871 4.228359 0.476413
H 0.480354 2.022178 2.074458
H -1.259939 2.219819 1.718450
H -1.742592 2.434908 -1.683812
H 1.393038 -0.559447 -0.342770
H -0.128011 -0.779246 1.553764
H -3.798649 1.432038 -2.600244
H -4.581403 -0.795845 -1.806089
H -4.291824 -2.760371 -0.357928
H -0.939646 -3.000273 2.332969
H -3.000201 -3.985064 1.385246
H 2.705629 -2.486573 0.787594
H 2.445999 -2.815307 -0.943394
H 5.081467 -2.887863 0.429184
H 4.841240 -3.192601 -1.155075


%chk=000194319-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194319

0 1
O 3.313178 2.265778 -1.315789
O 4.795694 -0.308892 -0.913924
N 0.054098 1.080465 -0.120829
N 2.500997 0.156512 -0.592523
N 4.472232 -3.022241 -0.051751
C 0.886097 1.970086 -0.981879
C 0.740513 3.425152 -0.428150
C 0.037092 3.254977 0.954422
C 0.095208 1.728553 1.240484
C -1.238656 0.642494 -0.588992
C 2.378675 1.504141 -0.972859
C -1.827642 -0.527185 0.034696
C -1.923966 1.283260 -1.633700
C -3.133481 -0.976659 -0.407618
C -1.156842 -1.279239 1.056323
C -3.194401 0.811261 -2.082691
C -3.799585 -0.287889 -1.474455
C -3.725152 -2.124123 0.218460
C -1.754115 -2.399734 1.639775
C 3.648251 -0.669495 -0.562381
C -3.056716 -2.820593 1.226862
C 3.340359 -2.101028 -0.029550
H 0.570192 1.889905 -2.036881
H 0.136415 4.050309 -1.107066
H 1.736842 3.890960 -0.348845
H 0.534911 3.835628 1.749796
H -1.015008 3.586306 0.900335
H 1.049052 1.461875 1.736501
H -0.736643 1.365845 1.862932
H -1.501580 2.175905 -2.106633
H 1.582533 -0.223054 -0.291761
H -0.153801 -0.974027 1.371655
H -3.699095 1.338796 -2.899326
H -4.783102 -0.640017 -1.805381
H -4.716539 -2.451151 -0.116957
H -1.221280 -2.965149 2.412062
H -3.519238 -3.696337 1.694718
H 2.964168 -2.003887 1.009598
H 2.505230 -2.528167 -0.619124
H 5.270704 -2.683175 0.496523
H 4.777197 -3.258770 -1.002274


