%chk=000274241.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274241

0 1
S 0.358962 -1.974381 0.321331
O 0.786212 -2.735067 1.474976
O -0.157695 -2.623679 -0.857667
O -3.091980 1.898504 3.031471
N -0.899872 -0.981990 1.006487
C 1.562698 -0.835479 -0.115944
C -1.835609 -0.192283 0.308298
C 2.586194 -0.522285 0.789184
C 1.541178 -0.223600 -1.375840
C 3.544488 1.025844 -0.814604
C -2.598313 0.785698 0.998776
C 3.570643 0.401786 0.446255
C 2.522523 0.702171 -1.725381
C -2.004873 -0.348855 -1.087619
C -3.484526 1.601849 0.267197
C 4.601798 2.007073 -1.189144
C -2.889897 0.471104 -1.776376
C -3.628663 1.459630 -1.107051
C -2.509610 1.000749 2.456715
H -1.011979 -1.009016 2.032753
H 2.619335 -1.012385 1.770007
H 0.754299 -0.474941 -2.096292
H 4.362880 0.638992 1.154919
H 2.497888 1.174106 -2.706562
H -1.491810 -1.151467 -1.627500
H -4.060076 2.357236 0.815351
H 4.242097 2.767656 -1.897069
H 5.005635 2.546912 -0.320514
H 5.452032 1.498152 -1.672071
H -3.018522 0.339207 -2.852647
H -4.313500 2.097639 -1.659459
H -1.877439 0.291122 3.020322


%chk=000274241-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000274241

0 1
S 0.313552 -2.111156 0.261848
O 0.794305 -2.947854 1.568707
O -0.144198 -2.847001 -1.112459
O -2.966285 1.857012 3.196155
N -1.051482 -1.127854 0.984902
C 1.603487 -0.813534 -0.182440
C -1.902583 -0.231709 0.306102
C 2.411988 -0.317743 0.852941
C 1.730686 -0.427581 -1.525268
C 3.559744 1.076766 -0.829319
C -2.581916 0.799589 1.044540
C 3.392963 0.637930 0.512413
C 2.719379 0.531808 -1.836099
C -2.108037 -0.329248 -1.098745
C -3.482518 1.664732 0.362339
C 4.639504 2.081351 -1.184028
C -2.973764 0.570192 -1.749791
C -3.677255 1.566078 -1.024382
C -2.337349 1.021215 2.487149
H -1.236101 -1.464781 1.934473
H 2.291968 -0.676387 1.880167
H 1.095130 -0.872546 -2.296966
H 4.039102 1.045008 1.298187
H 2.840662 0.856863 -2.875470
H -1.633234 -1.140951 -1.658129
H -3.996054 2.423996 0.962932
H 4.348159 2.704122 -2.047301
H 4.865521 2.751694 -0.337135
H 5.580584 1.564513 -1.454501
H -3.124976 0.472472 -2.830778
H -4.364198 2.244407 -1.539848
H -1.512285 0.418597 2.942105


