%chk=000262294.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262294

0 1
S 2.265362 -1.255179 0.077067
O -4.830429 -0.670897 -0.833021
O 2.320895 -2.068991 1.299994
O -5.033269 1.385979 0.082538
N 1.326575 0.200973 0.373868
C -0.071383 0.205393 0.257152
C -2.856271 0.346136 -0.071109
C -0.781528 1.365577 0.665665
C -0.774969 -0.886219 -0.303185
C -2.156763 1.428346 0.497713
C -2.154091 -0.806767 -0.461438
C 3.840056 -0.415509 -0.040353
C -4.314068 0.460819 -0.230114
C 4.839310 -0.693029 0.891001
C 4.068518 0.448026 -1.111725
C 6.097347 -0.097315 0.746518
C 5.326868 1.042456 -1.253745
C 6.338836 0.768363 -0.325494
C -6.277442 -0.733848 -1.030491
C -6.957465 -1.100791 0.272492
H -0.252270 2.204560 1.109466
H -0.261563 -1.796274 -0.602907
H 1.738938 0.984615 0.888851
H -2.713557 2.319210 0.806974
H -2.706893 -1.647807 -0.892990
H 4.638800 -1.371666 1.728243
H 3.280710 0.668009 -1.833808
H 6.885396 -0.308096 1.468172
H 5.519280 1.718346 -2.085463
H 7.318822 1.232357 -0.439134
H -6.621734 0.237071 -1.429867
H -6.347965 -1.525119 -1.798367
H -8.023480 -1.307229 0.126384
H -6.500640 -1.987762 0.729522
H -6.875331 -0.282137 1.003989


%chk=000262294-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000262294

0 1
S 2.287163 -1.270300 0.448049
O -4.940546 -0.590057 -0.885590
O 2.412898 -1.627762 2.057368
O -5.105866 1.347396 0.411767
N 1.336962 0.362658 0.141754
C -0.076574 0.334381 0.119407
C -2.915267 0.385863 -0.061127
C -0.824161 1.354771 0.777241
C -0.770750 -0.667874 -0.619417
C -2.224078 1.386280 0.671205
C -2.171669 -0.644909 -0.697941
C 3.960400 -0.444538 0.063999
C -4.397405 0.458425 -0.128835
C 4.939836 -0.533625 1.067080
C 4.189961 0.163339 -1.184816
C 6.212910 0.025773 0.807926
C 5.469148 0.716226 -1.429515
C 6.476034 0.645426 -0.436535
C -6.429198 -0.621091 -0.995100
C -7.047308 -1.357891 0.197017
H -0.299831 2.117885 1.364777
H -0.205129 -1.451675 -1.134384
H 1.754765 1.115592 0.711796
H -2.807534 2.170427 1.164774
H -2.707445 -1.413682 -1.261153
H 4.689382 -1.018390 2.018704
H 3.394462 0.226883 -1.934147
H 6.994805 -0.025539 1.573019
H 5.675237 1.201438 -2.389478
H 7.465052 1.073590 -0.633455
H -6.798850 0.417565 -1.057942
H -6.608881 -1.148488 -1.945929
H -8.140736 -1.445834 0.055295
H -6.628374 -2.374602 0.292454
H -6.864815 -0.806061 1.134130


