%chk=000195026.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195026

0 1
O 0.378402 2.413057 0.387003
O -1.797711 -1.373407 -0.953184
O -2.918565 0.288078 -1.950068
N -0.471236 0.315924 0.641297
N 4.451804 -1.579758 -0.689125
C 1.926476 0.687858 1.080020
C 2.542318 -0.164460 -0.032994
C -1.826755 0.718408 0.227801
C 0.579798 1.244500 0.665245
C 3.959251 -0.625864 0.348043
C -2.851893 0.474591 1.333333
C -2.254530 -0.075799 -1.013400
H 2.590597 1.549781 1.316645
H 1.845109 0.109740 2.021778
H 2.570551 0.411565 -0.980242
H 1.912070 -1.054052 -0.242889
H -1.813321 1.817699 -0.056627
H -0.329445 -0.674045 0.829967
H 4.622567 0.254789 0.490045
H 3.934575 -1.168431 1.320146
H -2.912130 -0.581836 1.624937
H -2.592842 1.047275 2.235570
H -3.856967 0.794319 1.025791
H 5.380463 -1.913307 -0.448827
H 4.524693 -1.123155 -1.593474
H -2.057079 -1.909470 -1.750190


%chk=000195026-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000195026

0 1
O 0.541097 1.774688 0.018101
O -2.658288 -1.816942 -0.208942
O -4.091366 -0.205440 -1.074792
N -0.717637 -0.143121 0.353044
N 5.321538 -0.420666 -0.539063
C 1.709149 -0.243387 0.808256
C 2.904020 -0.048289 -0.154315
C -1.965782 0.515446 -0.056169
C 0.480565 0.550724 0.358163
C 4.218592 -0.611131 0.421930
C -2.568086 1.406280 1.068863
C -3.012080 -0.490049 -0.519636
H 1.993950 0.132427 1.812528
H 1.470640 -1.319190 0.920469
H 3.011293 1.035968 -0.352395
H 2.704832 -0.536531 -1.126246
H -1.735691 1.179516 -0.911791
H -0.752917 -1.138140 0.581749
H 4.396342 -0.137848 1.421343
H 4.106531 -1.698772 0.601188
H -2.806362 0.802913 1.962199
H -1.824036 2.173215 1.337182
H -3.486353 1.902541 0.712059
H 6.190000 -0.907152 -0.298423
H 5.486193 0.559536 -0.790061
H -3.379944 -2.432598 -0.508641


