%chk=000282976.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282976

0 1
O 1.950641 -1.537368 -0.045879
O -4.025852 1.876902 0.003790
N 2.527316 0.705046 -0.071937
N -2.336980 0.300338 0.035541
C 1.229922 1.312948 -0.065661
C 1.142824 2.732738 -0.099824
C -1.193554 1.158409 -0.012239
C 0.069724 0.533052 -0.023371
C -0.126617 3.319361 -0.087508
C -1.294337 2.556006 -0.043907
C 2.357925 3.602947 -0.148779
C 2.807762 -0.677234 -0.053897
C 4.281308 -0.967367 -0.057365
C -3.686984 0.712116 0.051600
C -4.648243 -0.438505 0.118810
C 4.840062 -1.622313 -1.161861
C 5.073752 -0.627376 1.046182
C -5.569854 -0.607778 -0.922379
C -4.652983 -1.302011 1.221568
C 6.204888 -1.925125 -1.165476
C 6.436527 -0.937401 1.037510
C -6.490777 -1.657829 -0.864387
C -5.579809 -2.346771 1.275130
C 7.001832 -1.582523 -0.068104
C -6.495074 -2.526466 0.232079
H 0.147550 -0.559427 -0.000464
H -0.214056 4.407253 -0.112914
H -2.272882 3.046326 -0.035778
H 3.322002 1.349880 -0.108317
H 2.961310 3.408953 -1.046518
H 2.096499 4.670853 -0.179450
H 2.991851 3.466973 0.738193
H -2.135480 -0.705091 0.041910
H 4.210791 -1.901029 -2.008502
H 4.629490 -0.135842 1.911733
H -5.571401 0.082254 -1.767732
H -3.946723 -1.155197 2.038979
H 6.645355 -2.433723 -2.022328
H 7.057533 -0.679889 1.894533
H -7.208225 -1.795245 -1.672417
H -5.590088 -3.019793 2.131448
H 8.064887 -1.822613 -0.072207
H -7.215329 -3.343040 0.275897


%chk=000282976-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000282976

0 1
O 2.000798 -1.560444 -0.170878
O -4.133872 1.873559 -0.070209
N 2.514109 0.732157 -0.066762
N -2.363777 0.330879 -0.042553
C 1.221212 1.329943 -0.052257
C 1.155787 2.760441 -0.022397
C -1.228961 1.189764 -0.037136
C 0.038972 0.555500 -0.061219
C -0.124342 3.354834 -0.001653
C -1.319181 2.604644 -0.008817
C 2.413302 3.613657 -0.010713
C 2.854246 -0.620970 -0.089118
C 4.334230 -0.908388 -0.030368
C -3.715946 0.673977 -0.026353
C -4.674357 -0.491544 0.024121
C 4.772228 -2.159150 -0.536841
C 5.287056 -0.018468 0.534126
C -6.003544 -0.251069 -0.410006
C -4.328658 -1.781352 0.509473
C 6.139099 -2.502908 -0.509124
C 6.655505 -0.365538 0.565760
C -6.962347 -1.284192 -0.387309
C -5.290805 -2.814742 0.535712
C 7.086377 -1.604526 0.037384
C -6.607562 -2.571745 0.081026
H 0.130310 -0.533978 -0.089779
H -0.192442 4.448900 0.020244
H -2.297345 3.086327 0.001550
H 3.294714 1.389580 -0.101398
H 3.041925 3.453315 -0.910622
H 2.151616 4.684243 0.007605
H 3.043849 3.421775 0.881877
H -2.146066 -0.666076 -0.100603
H 4.019441 -2.844606 -0.939434
H 4.972927 0.926191 0.996176
H -6.257514 0.757217 -0.752780
H -3.328773 -1.987316 0.912018
H 6.466755 -3.468380 -0.909516
H 7.381601 0.322093 1.012951
H -7.983736 -1.087963 -0.731151
H -5.016798 -3.803143 0.920377
H 8.148537 -1.871809 0.062503
H -7.352070 -3.375287 0.101792


