%chk=000271691.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271691

0 1
O -0.762770 -2.688636 -0.285725
O 5.733005 1.466814 0.510041
O 5.745190 -0.694843 0.556642
N -2.960702 -1.981756 -0.202086
N 5.187281 0.379435 0.399860
C -1.296492 -0.283551 0.119525
C -2.691212 0.294994 0.175249
C -0.416642 0.337440 -0.973207
C -3.648761 -0.749501 -0.016363
C -1.553847 -1.787043 -0.146115
C 1.041981 0.342474 -0.602127
C -3.120832 1.590406 0.390482
C -5.015710 -0.505957 -0.002685
C 1.723208 1.564524 -0.464608
C 1.729984 -0.866741 -0.407436
C -4.506089 1.847754 0.406085
C -5.429686 0.820957 0.212623
C 3.077788 1.581642 -0.137936
C 3.083199 -0.862355 -0.079668
C 3.752569 0.365632 0.053509
H -0.801751 -0.183959 1.120051
H -0.772605 1.369063 -1.186623
H -0.549986 -0.204977 -1.936581
H -3.416603 -2.868544 -0.361052
H -2.411005 2.400338 0.548571
H -5.742058 -1.299324 -0.148927
H 1.196304 2.506570 -0.613463
H 1.196685 -1.822768 -0.508743
H -4.855004 2.865382 0.574022
H -6.497559 1.043454 0.229055
H 3.620180 2.527133 -0.028794
H 3.628841 -1.800356 0.074128


%chk=000271691-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271691

0 1
O -0.799750 -2.739467 -0.501631
O 5.894081 1.520292 0.365845
O 5.832884 -0.736493 0.689910
N -3.025311 -1.979860 -0.298890
N 5.270858 0.387850 0.391196
C -1.351703 -0.333245 0.078331
C -2.751718 0.261927 0.171807
C -0.399546 0.382401 -0.939211
C -3.711170 -0.763331 -0.049690
C -1.634664 -1.823878 -0.270989
C 1.080683 0.364942 -0.574163
C -3.182793 1.569472 0.441455
C -5.094780 -0.518253 -0.011987
C 1.821146 1.577116 -0.584775
C 1.749788 -0.845732 -0.241508
C -4.576183 1.841689 0.483996
C -5.515927 0.808292 0.259516
C 3.194116 1.597462 -0.271560
C 3.121230 -0.844241 0.076107
C 3.826697 0.379603 0.057986
H -0.868656 -0.316850 1.076247
H -0.733787 1.430946 -1.033378
H -0.540763 -0.078730 -1.936527
H -3.467847 -2.875053 -0.508709
H -2.459940 2.373254 0.623218
H -5.826749 -1.314423 -0.183912
H 1.316815 2.516189 -0.840753
H 1.185879 -1.786049 -0.246294
H -4.926326 2.857575 0.693974
H -6.587442 1.033086 0.296103
H 3.776051 2.522796 -0.274897
H 3.651729 -1.765585 0.330887


