%chk=000285624.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285624

0 1
S 2.512798 -0.602146 -0.367460
O 3.382022 -0.795174 0.774489
O 2.912195 -1.145739 -1.661604
O 0.863830 1.778055 1.124618
N 0.108524 2.175842 -0.988867
N -2.919614 -2.618338 0.809739
C 2.331830 1.168639 -0.686081
C 1.062748 1.719114 -0.079711
C 0.933795 -1.170642 -0.016932
C 3.534267 1.895384 -0.094797
C -1.244896 2.572066 -0.526085
C -2.251881 1.431626 -0.742815
C -3.642128 1.816200 -0.221614
C 0.214054 -1.867435 -0.999392
C 0.376520 -1.005790 1.261806
C -4.642886 0.679354 -0.415689
C -1.052536 -2.370157 -0.736140
C -0.887891 -1.499952 1.554806
C -1.617279 -2.183709 0.551463
H 2.357326 1.314378 -1.796968
H 3.475137 2.977518 -0.267039
H 3.600196 1.742525 0.997479
H 4.480643 1.543074 -0.527867
H -1.552603 3.488072 -1.074954
H -1.191819 2.840653 0.557965
H -1.896700 0.515595 -0.223651
H -2.309811 1.162503 -1.813837
H 0.233064 2.076108 -1.989225
H -4.004434 2.726960 -0.737120
H -3.580942 2.078366 0.853837
H 0.663436 -2.023825 -1.989738
H 0.939935 -0.467401 2.037899
H -5.624029 0.940967 -0.004425
H -4.783253 0.440183 -1.475636
H -4.308994 -0.238884 0.084684
H -1.601799 -2.901628 -1.506881
H -1.312713 -1.351601 2.543743
H -3.232969 -2.678160 1.765602
H -3.342744 -3.289704 0.189503


%chk=000285624-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000285624

0 1
S 1.976072 -0.258651 -1.052611
O 3.503542 -0.847469 -1.020506
O 1.201933 0.004327 -2.492162
O 0.235292 2.721163 0.974152
N 0.024636 2.288663 -1.318727
N -1.408621 -4.021549 2.277926
C 2.059852 1.547037 -0.149964
C 0.675742 2.219813 -0.109327
C 0.918062 -1.394112 -0.017208
C 2.727371 1.358335 1.202230
C -1.294997 2.927311 -1.453235
C -2.472745 1.933021 -1.308002
C -3.844028 2.624776 -1.475057
C -0.479117 -1.384509 -0.188038
C 1.567240 -2.266669 0.876735
C -5.026022 1.640274 -1.342199
C -1.256308 -2.265290 0.582541
C 0.786435 -3.146306 1.644933
C -0.637370 -3.154391 1.515482
H 2.719729 2.033824 -0.893073
H 2.954354 2.351583 1.627919
H 2.057916 0.848233 1.914581
H 3.670734 0.796202 1.092403
H -1.342497 3.422974 -2.441679
H -1.369130 3.704276 -0.671966
H -2.413697 1.457918 -0.308812
H -2.371195 1.127596 -2.064854
H 0.391262 1.698223 -2.089526
H -3.887555 3.121815 -2.465858
H -3.942371 3.427715 -0.716942
H -0.945239 -0.721995 -0.923608
H 2.660307 -2.267975 0.942234
H -5.996303 2.155946 -1.462338
H -4.968021 0.845972 -2.110205
H -5.023998 1.151602 -0.349554
H -2.345766 -2.274417 0.463115
H 1.272795 -3.835546 2.344746
H -0.977050 -4.661085 2.939175
H -2.420845 -4.035738 2.190380


