%chk=000202102.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202102

0 1
O -2.678017 1.100567 -2.064146
N -1.470991 2.482043 -0.748334
N 4.294805 0.562826 0.392367
C -1.421858 0.020334 -0.259097
C 0.080445 0.129804 -0.054945
C -1.744736 -1.280897 -1.038139
C -2.217086 0.066587 1.068230
C -1.911622 1.215823 -1.120525
C 0.904596 0.385446 -1.166978
C 0.692044 -0.050964 1.191623
C -1.331561 -2.520201 -0.304222
C -3.708196 0.123676 0.897335
C 2.900751 0.317132 0.226317
C 2.284735 0.480182 -1.038626
C 2.075456 0.039644 1.338872
C -2.117439 -3.585340 -0.159952
C -4.549048 0.130267 1.930100
C 5.147057 0.390944 -0.817034
C 4.934384 -0.032220 1.598643
H -1.238733 -1.260061 -2.028109
H -2.829711 -1.294255 -1.284809
H -1.887089 0.937364 1.673114
H -1.960044 -0.836246 1.666911
H 0.456782 0.511780 -2.155371
H 0.093450 -0.276285 2.075127
H -0.314468 -2.498584 0.094846
H -4.071942 0.161448 -0.134542
H 2.885810 0.690113 -1.921064
H 2.508971 -0.098423 2.326805
H -0.777747 2.633050 -0.037158
H -1.758606 3.287851 -1.281125
H -1.806870 -4.485242 0.349127
H -3.128029 -3.643713 -0.537132
H -5.622047 0.173835 1.813223
H -4.241036 0.091863 2.963473
H 4.778448 1.046863 -1.625658
H 5.181116 -0.643455 -1.193174
H 6.176079 0.714691 -0.589512
H 5.979084 0.313218 1.668064
H 4.929545 -1.133365 1.606814
H 4.418816 0.328900 2.506058


%chk=000202102-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202102

0 1
O -2.905114 1.325866 -1.895108
N -1.272665 2.558002 -0.813153
N 4.358345 0.213189 0.340234
C -1.454380 0.134770 -0.254923
C 0.074101 0.180199 -0.048755
C -1.866293 -1.158639 -1.043506
C -2.229861 0.181220 1.114209
C -1.933098 1.372288 -1.082038
C 0.931230 0.220062 -1.183980
C 0.706240 0.153759 1.220064
C -1.441843 -2.440743 -0.360913
C -3.740484 0.192519 0.991877
C 2.964758 0.204332 0.214708
C 2.331137 0.232310 -1.070466
C 2.109506 0.167059 1.359545
C -2.281974 -3.446614 -0.008226
C -4.568265 -0.627450 1.686670
C 5.203954 0.239565 -0.858898
C 4.973725 0.178352 1.671519
H -1.405844 -1.108663 -2.050585
H -2.957975 -1.139902 -1.199262
H -1.906118 1.088476 1.666302
H -1.926622 -0.698172 1.712935
H 0.490354 0.246387 -2.188770
H 0.104637 0.114370 2.133700
H -0.363699 -2.550852 -0.166926
H -4.173800 0.934228 0.305767
H 2.933207 0.263298 -1.983073
H 2.535193 0.141700 2.366754
H -0.423900 2.569043 -0.247973
H -1.582233 3.406133 -1.287002
H -1.912506 -4.367328 0.459133
H -3.363501 -3.374950 -0.178424
H -5.657726 -0.558057 1.587993
H -4.179968 -1.396735 2.366523
H 5.027630 1.148909 -1.469661
H 5.030154 -0.643986 -1.506938
H 6.264001 0.235063 -0.559966
H 6.070365 0.190714 1.569530
H 4.694767 -0.737398 2.232827
H 4.680061 1.054675 2.285655


