%chk=000296610.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296610

0 1
O 4.026346 -0.725413 -0.462396
O -1.462093 1.918790 1.366430
N -2.232989 -1.212137 -0.261949
N -3.407037 -1.682743 -0.728846
C 0.159172 0.486783 0.397761
C -1.228360 0.945893 0.682241
C -2.328090 0.138663 0.105180
C 0.543590 0.069891 -0.891540
C 1.109294 0.538014 1.428345
C 2.782899 -0.297223 -0.080517
C 1.847640 -0.328260 -1.141565
C 2.426065 0.133066 1.205710
C -3.651377 0.520111 -0.158110
C -4.292553 -0.639043 -0.683578
C 5.087468 -0.718901 0.526403
H -0.186337 0.074447 -1.705132
H 0.810465 0.900485 2.416704
H 2.171423 -0.651228 -2.129281
H 3.148157 0.167434 2.014897
H -4.087592 1.486535 0.007804
H -1.421831 -1.809358 -0.176551
H -5.315180 -0.739711 -1.008578
H 4.845819 -1.400182 1.346998
H 5.272713 0.300288 0.877756
H 5.938186 -1.093601 -0.059284


%chk=000296610-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296610

0 1
O 4.142523 -0.761047 -0.441460
O -1.464252 1.707297 1.597136
N -2.375352 -1.140620 -0.504751
N -3.606247 -1.537999 -0.985616
C 0.149607 0.347399 0.425277
C -1.245678 0.788346 0.742165
C -2.392374 0.131047 0.070411
C 0.532216 -0.191724 -0.838514
C 1.153086 0.539901 1.410501
C 2.851135 -0.369904 -0.086702
C 1.867144 -0.542325 -1.095545
C 2.491860 0.179206 1.173516
C -3.723154 0.583642 -0.062458
C -4.423735 -0.462790 -0.721814
C 5.214175 -0.580426 0.546252
H -0.202796 -0.281888 -1.645902
H 0.857350 0.983281 2.367197
H 2.177868 -0.935805 -2.067758
H 3.238830 0.328540 1.958309
H -4.100338 1.542630 0.282594
H -1.598029 -1.798885 -0.534577
H -5.469178 -0.509848 -1.019255
H 5.022214 -1.177125 1.458094
H 5.335001 0.486345 0.813677
H 6.123920 -0.944649 0.048125


