%chk=000239709.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239709

0 1
O 3.994361 1.036507 0.343272
O -2.645747 -2.023529 0.426018
O 0.414093 1.466310 -1.087500
N 1.495993 -0.575530 -1.221750
N -0.665863 -0.416086 -0.237549
C 2.782593 0.096063 -1.543625
C -1.934078 0.181856 0.040850
C 3.792977 -0.089812 -0.472400
C -3.006810 -0.685306 0.421300
C 0.409272 0.270649 -0.846643
C -2.173835 1.557201 -0.002588
C 4.599483 -1.122311 -0.061898
C -4.261817 -0.182824 0.747424
C -3.441533 2.060961 0.324353
C -4.473304 1.204280 0.695803
C 5.352851 -0.637754 1.068101
C 4.962416 0.659489 1.277247
C -3.669216 -2.991843 0.755344
H 2.602658 1.191763 -1.730831
H 3.152717 -0.334181 -2.507333
H 1.605501 -1.476000 -0.755192
H -0.646121 -1.438973 -0.167443
H -1.371412 2.245321 -0.298355
H 4.682660 -2.103795 -0.485067
H -5.075354 -0.839676 1.038301
H -3.609136 3.136303 0.283414
H -5.454065 1.603215 0.949042
H 6.076097 -1.207236 1.618830
H 5.209540 1.439030 1.962847
H -4.486705 -2.941839 0.029899
H -4.021158 -2.836331 1.779561
H -3.119958 -3.937823 0.666268


%chk=000239709-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239709

0 1
O 3.855228 0.346031 0.947417
O -2.544932 -1.897841 0.645038
O 0.368574 1.696798 -1.092396
N 1.475764 -0.349895 -0.870886
N -0.781042 -0.204054 -0.282326
C 2.770904 0.206404 -1.291075
C -2.080619 0.321742 -0.091865
C 3.898732 -0.157826 -0.373557
C -3.053287 -0.596275 0.415523
C 0.346686 0.469582 -0.767363
C -2.471849 1.654875 -0.359591
C 5.059199 -0.900182 -0.537942
C -4.381344 -0.194631 0.649070
C -3.808119 2.055181 -0.124999
C -4.760264 1.142953 0.375337
C 5.778827 -0.866725 0.720288
C 5.019641 -0.107235 1.592777
C -3.467070 -2.901955 1.173223
H 2.621898 1.301479 -1.339755
H 3.039595 -0.135929 -2.309718
H 1.440086 -1.333165 -0.599298
H -0.701205 -1.190273 -0.016929
H -1.723663 2.350900 -0.743199
H 5.365826 -1.408255 -1.450587
H -5.120172 -0.901750 1.038238
H -4.098724 3.089802 -0.336108
H -5.792828 1.459946 0.555634
H 6.731404 -1.343217 0.942721
H 5.131668 0.198899 2.628963
H -4.308557 -3.075695 0.475292
H -3.860727 -2.599603 2.162614
H -2.872531 -3.821987 1.275159


