%chk=000236582.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236582

0 1
O 1.388470 0.090835 -1.761051
N -0.652340 2.658282 0.759905
C 1.465808 -0.053862 -0.322855
C 2.616588 0.850588 0.190111
C 1.849245 -1.509966 0.030776
C 0.071633 0.362592 0.206170
C 3.678776 -0.065904 0.812847
C 3.345816 -1.502034 0.366927
C -0.385258 1.724502 -0.383409
C -0.988379 -0.685769 -0.056964
C -1.176239 -1.220401 -1.341421
C -1.815220 -1.111483 0.993706
C -1.883056 3.468508 0.523084
C 0.516986 3.549586 1.016078
C -2.170055 -2.173772 -1.568174
C -2.810273 -2.065866 0.762231
C -2.989118 -2.600483 -0.516827
H 0.179628 0.484302 1.320618
H 2.247782 1.600560 0.920463
H 3.030597 1.438024 -0.648061
H 1.606546 -2.191920 -0.801467
H 1.256109 -1.872125 0.890140
H 3.655445 0.009379 1.914680
H 4.695868 0.225275 0.504653
H 3.946987 -1.786172 -0.514150
H 3.587302 -2.235235 1.153807
H 0.373799 2.105083 -1.100006
H -1.303980 1.575817 -0.990564
H 2.209959 -0.221334 -2.183127
H -0.531448 -0.883155 -2.158368
H -1.690756 -0.690258 1.989981
H -2.743340 2.785496 0.425246
H -1.849255 4.116900 -0.364050
H -2.073223 4.099835 1.405600
H 0.328876 4.131699 1.931735
H 0.754852 4.250207 0.202986
H 1.409407 2.919191 1.204598
H -2.308865 -2.584981 -2.566045
H -3.448163 -2.391101 1.581660
H -3.762714 -3.343140 -0.694961


%chk=000236582-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236582

0 1
O 1.507952 0.015131 -1.816492
N -1.098908 2.551453 0.430399
C 1.635564 -0.078889 -0.330692
C 2.889734 0.743922 0.137315
C 1.969383 -1.540684 0.076448
C 0.291249 0.451115 0.246878
C 4.008691 -0.289289 0.488067
C 3.504651 -1.643612 -0.083594
C -0.056537 1.847686 -0.350399
C -0.880085 -0.522917 0.101156
C -1.312191 -0.982915 -1.171816
C -1.576040 -0.974863 1.249825
C -1.888262 3.497160 -0.380604
C -0.584489 3.173587 1.662539
C -2.403548 -1.872048 -1.285399
C -2.670125 -1.863617 1.141027
C -3.088604 -2.317671 -0.130168
H 0.476315 0.578579 1.332857
H 2.646757 1.376216 1.010878
H 3.193799 1.425112 -0.677205
H 1.394314 -2.267543 -0.521242
H 1.697234 -1.695932 1.139131
H 4.115696 -0.376092 1.585859
H 4.995735 0.001404 0.086629
H 3.784454 -1.746442 -1.153384
H 3.932313 -2.516106 0.440758
H 0.875977 2.460881 -0.433582
H -0.424929 1.700300 -1.379419
H 2.288165 -0.439838 -2.223395
H -0.773063 -0.650405 -2.064628
H -1.267055 -0.615410 2.239719
H -2.337234 2.964741 -1.237187
H -1.289861 4.356986 -0.779645
H -2.710355 3.913491 0.230149
H -1.423107 3.594814 2.245925
H 0.150023 3.998825 1.466759
H -0.083180 2.420225 2.295834
H -2.721225 -2.218734 -2.276113
H -3.196810 -2.195646 2.043442
H -3.937600 -3.005273 -0.220126


