%chk=000252276.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252276

0 1
S -1.179085 2.044964 0.359731
O -0.716292 -0.336085 -1.599144
O 2.743056 -0.832639 1.144636
N 1.667264 0.705227 -0.218302
N -1.132572 -1.676703 0.171144
N 1.921775 -1.596851 -0.859771
C -2.199879 0.553126 0.105619
C 0.091317 1.535045 1.555722
C 1.465657 1.658595 0.895962
C -3.305976 0.962632 -0.848109
C -1.296006 -0.488515 -0.533020
C 2.151335 -0.582997 0.103103
H -2.630244 0.216818 1.076655
H -0.079328 0.513491 1.939092
H 0.020771 2.208694 2.433592
H 2.263510 1.489030 1.665148
H 1.625357 2.685216 0.489541
H -2.907957 1.268206 -1.831184
H -4.001436 0.131962 -1.032924
H -3.897671 1.802851 -0.457963
H 1.005235 0.811619 -1.002672
H -1.518131 -1.844821 1.081840
H -0.455478 -2.358082 -0.156337
H 1.559594 -1.350295 -1.775316
H 2.584186 -2.362287 -0.867443


%chk=000252276-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252276

0 1
S -1.266718 2.152306 0.412407
O -0.800182 -0.465164 -1.688146
O 2.959871 -0.901369 0.978535
N 1.563433 0.625635 -0.132336
N -0.987256 -1.570624 0.341707
N 1.913761 -1.513639 -1.028290
C -2.237622 0.532347 0.050465
C 0.095439 1.615038 1.637078
C 1.491761 1.575117 0.975278
C -3.334843 0.909228 -0.959389
C -1.293899 -0.535077 -0.514236
C 2.199613 -0.608031 0.001351
H -2.676468 0.205350 1.010325
H -0.177474 0.626212 2.043613
H 0.067160 2.355249 2.455181
H 2.244050 1.258899 1.721697
H 1.762734 2.588657 0.624190
H -2.877994 1.203975 -1.918634
H -3.994281 0.042062 -1.145746
H -3.950666 1.741644 -0.578230
H 0.970981 0.804537 -0.948373
H -1.374967 -1.628503 1.282024
H -0.242200 -2.218992 0.070022
H 1.213293 -1.303972 -1.746720
H 2.511478 -2.332685 -1.104171


