%chk=000267919.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267919

0 1
S -0.844119 0.693178 0.879002
O -0.879927 0.717688 2.320531
O -1.316745 1.827454 0.127943
O 0.281203 -0.038662 -1.981599
O 4.683459 -0.146704 -0.644603
N -1.590701 -0.764497 0.356633
N 1.760087 0.522237 1.246698
N 2.473670 -0.107704 -1.378009
N 3.035757 0.338381 0.910110
C -2.483033 -1.438845 1.353634
C -2.364410 -0.687323 -0.924810
C -3.938844 -1.199064 0.901355
C -3.861202 -0.701588 -0.554469
C 0.831274 0.404848 0.336018
C 1.071887 0.081892 -1.080533
C 3.506761 0.007161 -0.424595
H -2.298212 -1.084788 2.390565
H -2.233835 -2.522851 1.331198
H -2.088808 -1.581450 -1.526994
H -2.084350 0.202351 -1.530093
H -4.437469 -0.454108 1.545777
H -4.534161 -2.123626 0.979502
H -4.432235 -1.353044 -1.235820
H -4.299687 0.308091 -0.649302
H 2.742403 -0.335464 -2.347724
H 3.732435 0.446537 1.667784


%chk=000267919-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267919

0 1
S -0.935349 0.761736 0.710279
O -1.019350 0.920164 2.327943
O -1.442070 1.963912 -0.269246
O 0.430515 -0.015598 -2.114854
O 4.858949 -0.111393 -0.529003
N -1.624892 -1.025542 0.203243
N 1.762519 0.529479 1.231862
N 2.638521 -0.053023 -1.327937
N 3.089156 0.343349 0.943399
C -2.486122 -1.531384 1.335250
C -2.543661 -0.838572 -0.974471
C -3.981885 -1.346717 0.922715
C -3.930554 -0.502313 -0.383520
C 0.904190 0.422262 0.251780
C 1.232718 0.110158 -1.160359
C 3.633505 0.044879 -0.333050
H -2.221455 -0.995464 2.266735
H -2.215058 -2.593893 1.474011
H -2.542200 -1.815568 -1.497803
H -2.134729 -0.081553 -1.662185
H -4.567224 -0.846071 1.711570
H -4.447070 -2.329502 0.726197
H -4.753498 -0.744123 -1.077301
H -3.974532 0.579762 -0.162352
H 2.967478 -0.270610 -2.275848
H 3.733294 0.435726 1.731146


