%chk=000191661.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191661

0 1
O 0.041026 2.181312 0.363722
O -1.867975 -1.971202 -0.770714
N -1.888017 0.134814 0.065249
C -1.168132 0.649380 -1.138599
C 0.209960 1.238662 -0.722001
C -1.985906 1.097894 1.186571
C -0.583200 1.624667 1.537276
C -2.011034 1.709817 -1.850187
C 1.277066 0.220980 -0.376205
C -2.142015 -1.240142 0.172944
C 2.415644 0.674539 0.311887
C 1.188537 -1.125654 -0.746408
C -2.796580 -1.751293 1.423906
C 3.449839 -0.209020 0.623222
C 2.227990 -2.008813 -0.435496
C 3.358945 -1.554333 0.247361
H -1.004785 -0.220239 -1.841755
H 0.593927 1.921103 -1.522420
H -2.467507 0.645322 2.075668
H -2.637330 1.944206 0.862832
H -0.617270 2.492396 2.219051
H 0.067304 0.835288 1.953949
H -1.605205 1.935684 -2.842620
H -3.044117 1.367355 -1.990142
H -2.045271 2.650554 -1.285051
H 2.478793 1.723774 0.604966
H 0.302705 -1.505869 -1.269561
H -2.145183 -1.655827 2.301939
H -3.019155 -2.826184 1.306632
H -3.748782 -1.249903 1.637653
H 4.328688 0.148857 1.155967
H 2.149200 -3.055146 -0.727656
H 4.166641 -2.242876 0.486417


%chk=000191661-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191661

0 1
O 0.045980 2.240328 0.388975
O -2.147828 -1.952613 -0.976341
N -1.807337 0.079854 0.099775
C -1.142177 0.647146 -1.109797
C 0.232106 1.246965 -0.715141
C -1.923000 0.999365 1.250106
C -0.541929 1.602328 1.578891
C -2.037168 1.699308 -1.801913
C 1.336136 0.243701 -0.359879
C -2.312359 -1.216842 0.052019
C 2.565090 0.763220 0.127907
C 1.204700 -1.158603 -0.523842
C -3.059671 -1.737529 1.278607
C 3.640209 -0.094125 0.442479
C 2.284317 -2.018215 -0.210283
C 3.503426 -1.492771 0.272274
H -1.003060 -0.202102 -1.800196
H 0.578636 1.889473 -1.546426
H -2.308564 0.460286 2.129744
H -2.632747 1.816849 1.011860
H -0.634334 2.409803 2.324107
H 0.137846 0.815550 1.964489
H -1.607199 1.973753 -2.782377
H -3.046153 1.287508 -1.977361
H -2.120738 2.621729 -1.200931
H 2.661543 1.845966 0.269690
H 0.271402 -1.596445 -0.894859
H -2.388704 -1.842115 2.151376
H -3.455043 -2.731622 1.023908
H -3.901282 -1.082563 1.568157
H 4.582010 0.324642 0.815224
H 2.167426 -3.099685 -0.343757
H 4.337265 -2.162441 0.511912


