%chk=000209395.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209395

0 1
S -0.387207 -2.263291 0.144191
O 0.909489 2.569993 -0.140550
N 2.204502 -1.340056 0.076714
N 2.580593 1.032149 -0.064108
C -1.144853 0.211554 -0.013147
C -2.004678 1.425962 -0.112552
C -3.452185 1.111544 0.300745
C -3.949342 -0.203997 -0.319492
C -3.090608 -1.407823 0.123043
C -1.653763 -1.054343 0.071426
C 0.300625 0.229818 -0.016647
C 0.856006 -1.050273 0.062177
C 1.165619 1.385806 -0.080571
C 3.036721 -0.297872 0.012442
C 4.510210 -0.518939 0.021035
H -1.587535 2.249204 0.507323
H -1.971386 1.809565 -1.155600
H -3.514930 1.048888 1.404840
H -4.114655 1.944389 0.000639
H -3.926779 -0.123502 -1.423903
H -5.004714 -0.378153 -0.041773
H -3.316865 -2.283186 -0.519546
H -3.366998 -1.706802 1.157976
H 3.250753 1.804957 -0.108610
H 4.990672 -0.143066 -0.895166
H 4.749004 -1.598817 0.082814
H 4.995604 -0.040108 0.885102


%chk=000209395-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000209395

0 1
S -0.369071 -2.336776 0.176861
O 0.902629 2.610615 -0.187307
N 2.236998 -1.359300 0.091727
N 2.589139 0.988947 -0.078681
C -1.136046 0.227535 -0.010883
C -2.029904 1.451796 -0.094214
C -3.484638 1.116662 0.316787
C -3.973272 -0.194860 -0.343856
C -3.125546 -1.408997 0.124599
C -1.660624 -1.053607 0.087529
C 0.311026 0.231727 -0.021027
C 0.893658 -1.054008 0.073657
C 1.205093 1.381693 -0.103691
C 3.065696 -0.316567 0.013400
C 4.560077 -0.518776 0.022172
H -1.613606 2.259441 0.533405
H -2.008399 1.845773 -1.130305
H -3.542431 1.008944 1.418637
H -4.149875 1.955477 0.039101
H -3.896430 -0.098750 -1.444667
H -5.037324 -0.378154 -0.103809
H -3.333691 -2.288464 -0.515111
H -3.419273 -1.696041 1.155695
H 3.252404 1.768999 -0.135661
H 5.025643 -0.132069 -0.903821
H 4.768127 -1.595151 0.099584
H 5.032939 -0.002488 0.878679


