%chk=000296391.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296391

0 1
S -6.538830 -0.303487 -0.208456
O 4.344766 1.866017 -0.240161
O 5.760431 -0.016156 0.056582
N -0.584253 0.046076 -0.200900
C 3.579638 0.714984 -0.091741
C 4.433862 -0.415237 0.086418
C 1.685491 -0.704795 0.073558
C 2.209571 0.604982 -0.103614
C 3.934178 -1.687689 0.257579
C 2.527352 -1.809777 0.247823
C 5.742178 1.437121 -0.152083
C 0.220699 -0.928081 0.079342
C -2.003876 -0.107404 -0.189650
C -2.696384 -0.462172 0.983844
C -2.707411 0.214403 -1.367806
C -4.782175 -0.175690 -0.196411
C -4.093072 -0.487194 0.977040
C -4.101421 0.173042 -1.366741
C -7.060698 1.427691 -0.123244
H 1.548901 1.462873 -0.242766
H 4.580110 -2.550512 0.392374
H 2.100950 -2.805049 0.379973
H 6.186066 1.908614 0.734536
H 6.221398 1.643144 -1.118211
H -0.087850 -1.960450 0.323982
H -2.149659 -0.695018 1.894728
H -2.159698 0.496989 -2.266232
H -4.635813 -0.753513 1.886127
H -4.652309 0.410821 -2.278425
H -8.158262 1.443398 -0.116448
H -6.711256 2.001605 -0.987482
H -6.701923 1.914766 0.789665


%chk=000296391-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296391

0 1
S -6.641700 -0.142794 0.420619
O 4.491104 1.776240 -0.523242
O 5.857828 -0.150595 -0.085114
N -0.568048 0.186245 -0.068490
C 3.678599 0.650481 -0.232775
C 4.489741 -0.482684 0.023352
C 1.701539 -0.673590 0.119034
C 2.291717 0.594477 -0.194472
C 3.939608 -1.730123 0.329790
C 2.523642 -1.806895 0.373892
C 5.893620 1.306463 -0.400766
C 0.241078 -0.817547 0.181078
C -1.975009 0.066725 0.061127
C -2.631974 -0.814755 0.972718
C -2.776877 0.928175 -0.734478
C -4.824965 -0.005093 0.226690
C -4.034794 -0.846439 1.055051
C -4.183270 0.886060 -0.668165
C -7.278158 1.129832 -0.801244
H 1.648461 1.455559 -0.388847
H 4.572430 -2.599157 0.524397
H 2.049554 -2.766577 0.610403
H 6.383786 1.838550 0.433128
H 6.409319 1.448595 -1.365336
H -0.128914 -1.835628 0.428350
H -2.043548 -1.449686 1.645157
H -2.270442 1.622689 -1.412428
H -4.521387 -1.517377 1.772489
H -4.764413 1.556348 -1.308743
H -8.375347 1.085003 -0.723582
H -6.971440 0.872995 -1.827235
H -6.931039 2.138804 -0.529157


