%chk=000211768.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211768

0 1
O 6.426324 0.595345 -0.195762
N 0.963042 -0.413715 -0.528399
N 0.345051 -0.614827 1.822289
C -2.309312 0.187690 0.158308
C -1.328673 -0.856209 0.056268
C -3.659274 -0.120843 -0.156304
C -1.679815 -2.116179 -0.371311
C -1.978093 1.523194 0.553498
C -4.000694 -1.443488 -0.584498
C 0.094687 -0.579426 0.424771
C -4.655098 0.901904 -0.045313
C -3.034790 -2.411424 -0.695090
C -2.952552 2.484961 0.646992
C -4.310602 2.169777 0.349555
C 2.352967 -0.174653 -0.334464
C 3.173324 -1.024893 0.428030
C 2.918835 0.907349 -1.050446
C 4.550464 -0.798307 0.494830
C 4.284641 1.146627 -0.986768
C 5.083814 0.286441 -0.210449
H -0.927244 -2.900251 -0.471207
H -0.937178 1.770486 0.757731
H -5.040702 -1.661836 -0.825580
H -5.688108 0.651793 -0.284093
H -3.283522 -3.417326 -1.031628
H -2.704849 3.503681 0.942822
H -5.061697 2.953521 0.435985
H 1.190791 -0.176402 2.160352
H -0.442963 -0.489476 2.441696
H 2.739288 -1.875445 0.953798
H 2.272357 1.543030 -1.657956
H 5.186267 -1.456964 1.077205
H 4.748820 1.971223 -1.524267
H 6.947592 -0.050357 0.338304


%chk=000211768-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211768

0 1
O 6.667072 0.133226 -0.036749
N 1.058348 -0.438055 -0.713837
N 0.381505 0.330173 1.463365
C -2.418022 0.294605 0.213642
C -1.291540 -0.553709 -0.117307
C -3.758585 -0.204551 -0.045406
C -1.511414 -1.790282 -0.741721
C -2.286654 1.631576 0.729916
C -3.934632 -1.493043 -0.648032
C 0.134538 -0.199827 0.196338
C -4.891809 0.613388 0.279636
C -2.828911 -2.263244 -1.010672
C -3.410750 2.408328 1.021894
C -4.727785 1.892096 0.812946
C 2.447863 -0.272589 -0.450832
C 3.126537 -0.959929 0.598060
C 3.223309 0.524060 -1.342272
C 4.526333 -0.849009 0.751599
C 4.614950 0.653315 -1.182897
C 5.269627 -0.032899 -0.133201
H -0.638511 -2.390047 -1.017129
H -1.287992 2.059084 0.859265
H -4.952937 -1.855748 -0.832298
H -5.896089 0.217159 0.086748
H -2.964515 -3.238391 -1.490134
H -3.283887 3.428102 1.402181
H -5.600013 2.509482 1.053471
H 1.333554 0.581250 1.727792
H -0.361132 0.407625 2.153571
H 2.561427 -1.617984 1.268307
H 2.709791 1.028952 -2.166453
H 5.032145 -1.402991 1.554088
H 5.209832 1.267689 -1.865379
H 7.031445 -0.402813 0.710399


