%chk=000218254.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218254

0 1
O 2.767147 -0.646100 0.356237
N -5.008951 -0.162837 0.124372
N -3.395993 1.414719 0.261767
C 5.072468 -0.279561 0.317299
C 6.241093 0.703060 0.182243
C 3.731858 0.442627 0.204833
C -1.342273 -0.019929 0.249087
C 1.428656 -0.337707 0.308100
C -2.790771 0.150650 0.213467
C 7.585461 -0.011406 0.293623
C -0.777295 -1.297678 0.445457
C -0.494312 1.089795 0.089887
C 0.600741 -1.467898 0.475037
C 0.894479 0.942913 0.116414
C -3.784452 -0.840779 0.126347
C -4.733043 1.210775 0.208018
C -6.326660 -0.797266 0.048542
H 5.134409 -1.071347 -0.456736
H 5.123899 -0.819388 1.284729
H 6.169751 1.486407 0.962939
H 6.180283 1.233184 -0.789056
H 3.567862 1.172554 1.014882
H 3.578567 0.912996 -0.780563
H 7.695861 -0.517940 1.259712
H 7.706539 -0.770458 -0.488188
H 8.418310 0.694491 0.196778
H -1.425171 -2.163230 0.580009
H -0.930743 2.082815 -0.054578
H 1.053908 -2.444217 0.624925
H 1.528378 1.813124 -0.008978
H -3.696408 -1.905375 0.064718
H -5.487773 1.979805 0.226575
H -6.490531 -1.470437 0.910854
H -7.131526 -0.041770 0.050451
H -6.424067 -1.394791 -0.877203


%chk=000218254-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218254

0 1
O 2.809812 -0.814316 0.341210
N -5.075517 -0.099628 0.133743
N -3.378332 1.401042 0.052099
C 5.170881 -0.293610 0.326766
C 6.271083 0.786690 0.208276
C 3.764729 0.304217 0.243311
C -1.384036 -0.128106 0.204304
C 1.438761 -0.511411 0.288696
C -2.837109 0.098197 0.159758
C 7.692403 0.191138 0.299947
C -0.825428 -1.431978 0.330489
C -0.495056 0.973988 0.121592
C 0.565008 -1.625300 0.372816
C 0.903607 0.795449 0.161855
C -3.885867 -0.835289 0.210232
C -4.712336 1.242466 0.039089
C -6.437669 -0.643172 0.151628
H 5.289579 -1.043249 -0.479167
H 5.275277 -0.835147 1.286567
H 6.135889 1.543114 1.008383
H 6.157744 1.325837 -0.754413
H 3.587454 1.020385 1.073514
H 3.616194 0.837258 -0.719764
H 7.841002 -0.331058 1.263664
H 7.867578 -0.542365 -0.509197
H 8.465156 0.977088 0.217832
H -1.482827 -2.306764 0.397433
H -0.925263 1.975891 0.024956
H 0.999034 -2.625202 0.470279
H 1.557167 1.670169 0.094763
H -3.892021 -1.919011 0.288725
H -5.446409 2.042156 -0.033560
H -6.633298 -1.186044 1.093206
H -7.158460 0.186510 0.070778
H -6.599028 -1.330144 -0.697806


