%chk=000190126.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190126

0 1
S 1.554513 -0.242426 -1.112290
S -2.817232 -1.315488 0.243433
N 1.089827 -3.547721 0.114999
C 1.056240 -1.192519 0.375642
C 0.343790 -2.382354 -0.140917
C 2.296875 -1.760736 1.114148
C 2.356810 -3.289077 0.829002
C -0.838612 -2.766708 -0.779568
C 0.401071 -4.662765 -0.340232
C -0.794892 -4.193413 -0.900875
C -1.918321 -1.883363 -1.245548
C 2.053081 1.314976 -0.447775
C 1.159601 2.102612 0.280434
C 3.347539 1.755572 -0.731936
C -2.872543 0.439980 0.151110
C 1.577245 3.355711 0.740737
C 3.752909 3.014622 -0.275263
C 2.870959 3.811249 0.462883
C -2.161075 1.187937 -0.786800
C -3.675803 1.064840 1.114105
C -2.254395 2.583972 -0.764561
C -3.759767 2.459043 1.129059
C -3.050884 3.220581 0.191381
H 0.424784 -0.562878 1.040058
H 2.206518 -1.575048 2.199485
H 3.231036 -1.266980 0.792930
H 3.225056 -3.556130 0.190310
H 2.419400 -3.885528 1.761225
H 0.767113 -5.666634 -0.252497
H -1.557223 -4.798924 -1.346604
H -1.521833 -1.022991 -1.829762
H -2.640457 -2.409936 -1.901597
H 0.142670 1.759870 0.483557
H 4.036206 1.133562 -1.304164
H 0.890500 3.978566 1.312095
H 4.757458 3.372844 -0.493958
H 3.191063 4.788659 0.820200
H -1.532544 0.697450 -1.535765
H -4.234455 0.477353 1.842770
H -1.702435 3.172631 -1.496333
H -4.382626 2.955195 1.871841
H -3.124067 4.305594 0.205541


%chk=000190126-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000190126

0 1
S 1.518814 -0.079865 -1.220191
S -2.474129 -0.955978 1.076422
N 1.231213 -3.532039 -0.103685
C 1.196419 -1.211893 0.348236
C 0.405749 -2.406460 -0.057056
C 2.518812 -1.831418 0.897512
C 2.642231 -3.224984 0.207595
C -0.897432 -2.801211 -0.415847
C 0.499304 -4.647949 -0.478590
C -0.830231 -4.220708 -0.667820
C -2.100938 -1.923595 -0.556409
C 2.305078 1.370378 -0.390066
C 1.561885 2.183084 0.501599
C 3.656027 1.683913 -0.675741
C -3.070478 0.658688 0.409421
C 2.176792 3.298291 1.114664
C 4.260786 2.812568 -0.073508
C 3.525311 3.617506 0.827086
C -2.299556 1.409487 -0.513322
C -4.298825 1.173637 0.889431
C -2.769099 2.664638 -0.962460
C -4.751464 2.440733 0.452477
C -3.992338 3.186934 -0.478465
H 0.684249 -0.550983 1.062383
H 2.413141 -1.967748 1.990123
H 3.393724 -1.187775 0.713512
H 3.236724 -3.170091 -0.723716
H 3.084317 -3.989364 0.869125
H 0.944435 -5.635989 -0.570608
H -1.665140 -4.859400 -0.955084
H -1.966680 -1.141933 -1.321902
H -3.003582 -2.507131 -0.795674
H 0.508748 1.956997 0.703280
H 4.223040 1.050344 -1.366020
H 1.598065 3.922537 1.804529
H 5.304200 3.056105 -0.303413
H 3.996433 4.487798 1.297400
H -1.336151 1.025769 -0.873728
H -4.895743 0.581691 1.591103
H -2.169737 3.237606 -1.678953
H -5.701818 2.835046 0.829861
H -4.349055 4.163964 -0.823001


