%chk=000149775.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000149775

0 1
S -5.695607 0.827756 1.278799
O -1.322673 -1.915608 -2.651738
O 4.077539 4.226893 1.421225
O -7.011468 0.259912 1.454196
O -4.844385 1.088675 2.408646
N 0.377135 -0.010118 -1.753990
N 3.710468 -0.440794 0.917598
N -4.933250 -0.315433 0.224592
C 1.486293 -0.193953 -0.827849
C 2.101350 0.962114 -0.304418
C 1.984136 -1.473421 -0.497140
C 3.223241 0.792090 0.591690
C 3.119195 -1.543430 0.387027
C -0.931895 -0.160002 -1.159589
C 1.686327 2.300035 -0.638831
C 1.417699 -2.707929 -0.979265
C 3.853628 1.948790 1.155085
C -1.866039 -1.103561 -1.677897
C 3.661967 -2.840819 0.740473
C -1.354298 0.675147 -0.120052
C -3.581961 -0.284993 -0.191474
C 3.394539 3.199184 0.814547
C 2.301586 3.392156 -0.101235
C -3.178689 -1.167404 -1.222640
C -2.661279 0.616300 0.369821
C 1.951953 -3.909678 -0.622630
C 3.095415 -3.975598 0.248844
C -5.787633 2.262542 0.298494
C -2.179198 -2.903344 -3.275881
C 3.675769 5.587539 1.133768
H 0.481363 -0.626763 -2.578824
H 0.863000 2.413841 -1.352276
H 0.541412 -2.659440 -1.631915
H 4.689167 1.812796 1.842506
H 4.526440 -2.856425 1.406771
H -0.646909 1.378890 0.327388
H 1.984147 4.396815 -0.361248
H -3.882554 -1.878985 -1.637835
H -2.924265 1.236602 1.230557
H 1.527998 -4.844887 -0.982159
H 3.490219 -4.959023 0.504277
H -5.469816 -1.145615 -0.063170
H -6.651266 2.268826 -0.384611
H -5.880248 3.182614 0.898268
H -4.903447 2.427921 -0.338369
H -3.006623 -2.411765 -3.795819
H -2.531772 -3.622559 -2.530531
H -1.490913 -3.376664 -3.988816
H 4.382535 6.160203 1.750146
H 2.646543 5.759120 1.460531
H 3.815224 5.810648 0.072452


%chk=000149775-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149775

0 1
S -5.547457 2.096902 -0.554050
O -1.542556 -1.221679 -2.749831
O 3.732676 4.066831 1.749222
O -5.528026 3.592320 0.137636
O -4.919031 1.908884 -2.065185
N 0.432613 -0.924463 -1.047704
N 4.293652 -0.581916 0.835591
N -4.839025 0.274629 0.554693
C 1.688052 -0.787467 -0.395122
C 2.145228 0.467097 0.113413
C 2.542679 -1.932021 -0.316416
C 3.461575 0.508417 0.755218
C 3.857381 -1.762637 0.297231
C -0.832840 -0.590944 -0.569758
C 1.419768 1.699245 -0.020469
C 2.160071 -3.236711 -0.786300
C 3.936182 1.744170 1.297972
C -1.934424 -0.759780 -1.481746
C 4.742954 -2.896496 0.360169
C -1.106358 -0.134629 0.752344
C -3.512222 0.005866 0.229137
C 3.179788 2.911899 1.184341
C 1.912867 2.891987 0.497868
C -3.244257 -0.484080 -1.093258
C -2.412802 0.191823 1.132265
C 3.043466 -4.310767 -0.703881
C 4.351740 -4.136368 -0.134959
C -7.384038 1.583382 -0.680919
C -2.582875 -1.313249 -3.783549
C 2.983590 5.323698 1.637029
H 0.419910 -1.399002 -1.957366
H 0.462768 1.707084 -0.549095
H 1.153324 -3.393312 -1.189354
H 4.912930 1.757632 1.786892
H 5.724413 -2.734460 0.815896
H -0.283009 -0.027794 1.463228
H 1.333850 3.811084 0.369139
H -4.087964 -0.597413 -1.775981
H -2.606617 0.575501 2.141103
H 2.737943 -5.299951 -1.061757
H 5.034442 -4.991434 -0.080976
H -4.916938 0.629421 1.533859
H -7.808363 1.664904 0.329028
H -7.845521 2.291471 -1.383395
H -7.385990 0.550797 -1.051671
H -3.083836 -0.336782 -3.916212
H -3.328833 -2.087215 -3.521749
H -2.052952 -1.598837 -4.703591
H 3.603590 6.068221 2.156947
H 1.996182 5.251872 2.131917
H 2.852401 5.623470 0.579652


