%chk=000201666.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201666

0 1
O -0.850539 2.807273 -0.543091
O -1.424276 -1.182411 -0.371371
O 5.051536 -1.033715 0.051781
N -2.298510 1.242302 0.262700
N 3.767607 0.878121 -0.010951
C -3.417717 2.173115 0.280916
C -4.486874 2.001869 1.352128
C -4.805058 1.664849 -0.093430
C -1.046541 1.648673 -0.197860
C 0.052520 0.631583 -0.185360
C -0.114865 -0.765988 -0.277378
C 1.354940 1.141096 -0.104331
C 2.467752 0.281129 -0.096865
C 0.989156 -1.632910 -0.270063
C 2.276579 -1.112531 -0.177245
C -1.696827 -2.613489 -0.521119
C 4.991503 0.180603 0.057594
C -3.176824 -2.657169 -0.744928
C 6.195329 1.077181 0.138317
C -3.879063 -3.785961 -0.718503
H -3.114502 3.191870 -0.025870
H -4.923586 2.886663 1.809716
H -4.408359 1.201889 2.083953
H -4.951240 0.627547 -0.381428
H -5.467969 2.309938 -0.665543
H -2.486934 0.269828 0.511751
H 1.479429 2.229589 -0.058481
H 0.860243 -2.710216 -0.335604
H 3.141517 -1.790775 -0.167916
H 3.779538 1.899616 -0.004822
H -1.377778 -3.121459 0.406830
H -1.132685 -2.995338 -1.393055
H -3.629324 -1.680051 -0.943542
H 7.111703 0.463762 0.190659
H 6.298810 1.725939 -0.741769
H 6.189338 1.714240 1.032716
H -4.946684 -3.818295 -0.893266
H -3.456344 -4.761964 -0.525569


%chk=000201666-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201666

0 1
O -0.679624 2.902816 0.399483
O -1.476737 -1.228726 -0.320610
O 5.198620 -1.033700 -0.313092
N -2.316810 1.256780 0.195629
N 3.803870 0.824531 0.019828
C -3.414950 2.171787 0.386105
C -4.706811 1.695977 1.060404
C -4.698809 2.031493 -0.445143
C -1.004060 1.681312 0.212983
C 0.063104 0.624077 0.010611
C -0.140276 -0.768084 -0.239949
C 1.392576 1.092771 0.085623
C 2.507929 0.239097 -0.073542
C 0.970345 -1.629529 -0.393691
C 2.290073 -1.141945 -0.313469
C -1.717502 -2.659064 -0.628841
C 5.049871 0.205908 -0.097415
C -3.201212 -2.837024 -0.808336
C 6.230733 1.165230 0.058501
C -3.947691 -3.709379 -0.088062
H -3.053353 3.178526 0.605922
H -5.208999 2.379298 1.750742
H -4.775347 0.640427 1.343647
H -4.758858 1.196347 -1.150625
H -5.193316 2.945360 -0.785845
H -2.487597 0.254823 0.037468
H 1.506508 2.168350 0.274718
H 0.826495 -2.698439 -0.573116
H 3.144751 -1.809806 -0.432709
H 3.811636 1.832434 0.195022
H -1.330383 -3.287216 0.196833
H -1.175787 -2.911298 -1.563952
H -3.663651 -2.227196 -1.596550
H 7.162744 0.593720 -0.055887
H 6.205784 1.961980 -0.707945
H 6.229425 1.646635 1.054114
H -5.019170 -3.836945 -0.275841
H -3.508517 -4.324923 0.706689


