%chk=000247991.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247991

0 1
O 1.125739 1.481486 -2.303593
O -0.656302 0.231823 -2.743317
N -3.431421 1.240917 0.630850
C 0.179987 0.325077 -0.406404
C -1.002746 1.168301 0.202715
C -2.378120 0.587168 -0.213784
C 1.549602 0.688218 0.171721
C -0.027435 -1.158783 -0.093368
C -0.906445 2.640496 -0.201810
C 0.135166 0.615308 -1.908836
C 2.702178 0.183653 -0.458294
C 0.071584 -1.568671 1.249269
C 1.690958 1.446384 1.340981
C -0.306798 -2.116047 -1.076656
C -3.684934 0.448482 1.871619
C -4.698430 1.413499 -0.140108
C 3.968383 0.453298 0.062268
C -0.101632 -2.909293 1.595368
C 2.962281 1.715212 1.860034
C -0.477406 -3.459800 -0.725858
C 4.103135 1.222315 1.223687
C -0.375585 -3.861550 0.607491
H -0.915613 1.096190 1.316864
H -2.382986 -0.520191 -0.123488
H -2.555934 0.794406 -1.292694
H -1.154677 2.803655 -1.256467
H 0.091426 3.059540 -0.032849
H -1.629597 3.232532 0.379654
H 2.609177 -0.414583 -1.364020
H 0.295898 -0.839431 2.027722
H 0.815441 1.837629 1.860241
H -0.413329 -1.832229 -2.126977
H -4.110085 -0.552094 1.703855
H -4.375120 1.013759 2.517920
H -2.741145 0.331260 2.426731
H -5.436830 1.928701 0.494706
H -5.150242 0.480391 -0.506765
H -4.503049 2.068852 -1.004540
H 4.853646 0.062920 -0.437302
H -0.019412 -3.214648 2.637339
H 3.058388 2.312347 2.765430
H -0.692588 -4.193439 -1.501858
H 1.061350 1.711625 -3.271059
H 5.090927 1.433310 1.627537
H -0.507402 -4.907197 0.877344


%chk=000247991-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247991

0 1
O 1.185267 1.551429 -2.372658
O -0.689985 0.289193 -2.793759
N -3.470424 1.218144 0.616042
C 0.205478 0.349828 -0.465969
C -1.009133 1.195718 0.139931
C -2.405112 0.618744 -0.230410
C 1.576651 0.719687 0.167271
C -0.022650 -1.166649 -0.175409
C -0.964552 2.696132 -0.237094
C 0.178946 0.668875 -1.971584
C 2.744883 0.103799 -0.355770
C 0.077168 -1.590271 1.177938
C 1.719122 1.557919 1.298973
C -0.312558 -2.142484 -1.161766
C -3.587250 0.567525 1.937039
C -4.775861 1.292687 -0.070077
C 4.010960 0.327752 0.217613
C -0.120522 -2.938940 1.537786
C 2.988683 1.783782 1.882287
C -0.495815 -3.498905 -0.802808
C 4.141477 1.174277 1.344500
C -0.407298 -3.905642 0.545886
H -0.901057 1.100851 1.238527
H -2.401572 -0.492033 -0.149627
H -2.620159 0.858588 -1.286952
H -1.160671 2.836081 -1.317004
H 0.003629 3.171122 -0.009169
H -1.768008 3.215706 0.312343
H 2.658075 -0.566354 -1.219220
H 0.337538 -0.862889 1.955052
H 0.848983 2.047328 1.745755
H -0.422916 -1.849722 -2.208576
H -3.930537 -0.496469 1.871227
H -4.306861 1.124186 2.564433
H -2.613075 0.572751 2.456876
H -5.500788 1.828267 0.570440
H -5.211401 0.290298 -0.314235
H -4.670826 1.857782 -1.012817
H 4.895140 -0.159859 -0.208313
H -0.038443 -3.237153 2.589224
H 3.070912 2.438463 2.757489
H -0.716156 -4.235104 -1.584375
H 1.040113 1.772823 -3.334279
H 5.124340 1.349768 1.795995
H -0.553729 -4.956232 0.820541


