%chk=000190732.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190732

0 1
S 3.841885 -1.216390 0.449794
O 2.214467 2.256750 0.526435
O -2.279445 1.371958 -0.329559
N -2.054359 -0.936138 -0.250859
N -4.191191 0.113457 -0.658213
N 3.836846 0.521399 0.592560
C 1.531921 -0.045994 0.247315
C -0.633823 -1.002422 -0.109600
C 2.107029 -1.337421 0.215473
C 0.162525 0.140187 0.085156
C -0.053242 -2.297836 -0.144999
C 1.320291 -2.467495 0.018970
C 2.597826 0.957485 0.467798
C -2.798840 0.268428 -0.372512
C -4.981561 1.369564 -0.543538
C -4.911538 -1.088640 -0.169876
C 3.279011 3.234480 0.738510
H -0.268880 1.150780 0.105144
H -0.680513 -3.173519 -0.301394
H 1.761470 -3.463091 -0.008167
H -2.524728 -1.826838 -0.422031
H -4.358845 2.235165 -0.849536
H -5.346559 1.563679 0.476420
H -5.838139 1.312488 -1.234615
H -5.978519 -1.022586 -0.447889
H -4.854896 -1.221001 0.923164
H -4.515294 -1.991823 -0.664696
H 3.772162 3.043983 1.697038
H 2.714307 4.173189 0.742219
H 3.996434 3.186805 -0.087014


%chk=000190732-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190732

0 1
S 3.902841 -1.290105 0.486234
O 2.308219 2.295533 0.424687
O -2.369562 1.525110 -0.089917
N -2.093931 -0.814747 -0.144519
N -4.241983 0.141776 -0.360338
N 3.896656 0.536590 0.540521
C 1.560175 -0.030131 0.272904
C -0.684058 -0.912261 0.005730
C 2.095336 -1.347868 0.291012
C 0.173822 0.205517 0.131168
C -0.136508 -2.235620 0.025460
C 1.243577 -2.464510 0.166744
C 2.630377 0.955350 0.417512
C -2.867967 0.360666 -0.191325
C -5.132284 1.312964 -0.407424
C -4.841750 -1.194285 -0.485318
C 3.441473 3.233681 0.580656
H -0.229267 1.219214 0.118715
H -0.810192 -3.097142 -0.072464
H 1.633009 -3.486943 0.178216
H -2.579323 -1.708411 -0.224384
H -4.512566 2.215740 -0.298430
H -5.871788 1.282411 0.415771
H -5.672045 1.361702 -1.372620
H -5.927579 -1.084325 -0.632466
H -4.697880 -1.809315 0.427430
H -4.450751 -1.750240 -1.362507
H 3.963165 3.047221 1.535302
H 2.979233 4.230684 0.565514
H 4.157351 3.110344 -0.250364


