%chk=000291187.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291187

0 1
S 1.381709 -2.015429 0.259617
O 2.335341 -2.474217 1.234503
O 0.739613 -2.982707 -0.612370
N 0.169356 -1.183570 1.148884
N 2.501234 0.640347 1.095924
C 2.083762 -0.820463 -0.794880
C 2.621956 0.390313 -0.269488
C -1.145386 -0.866665 0.728390
C -3.178614 0.449120 1.019029
C 3.261161 1.319655 -1.141803
C -3.774167 -0.219647 -0.083484
C -1.851905 0.113164 1.412859
C 2.153982 -1.066308 -2.146127
C -1.750910 -1.553916 -0.377098
C -3.024299 -1.232235 -0.762726
C 3.322038 1.026704 -2.538159
C 2.774533 -0.134694 -3.027186
C -3.931564 1.456063 1.707381
C 3.812399 2.509383 -0.570851
C -5.102562 0.126815 -0.479746
C -5.205588 1.767616 1.304043
C -5.801058 1.096634 0.196176
C 3.705879 2.728524 0.779246
C 3.027934 1.758630 1.588184
H 0.467795 -0.727222 2.028289
H -1.413120 0.637083 2.256769
H 1.731942 -1.990161 -2.569694
H -1.205613 -2.357959 -0.887346
H -3.493093 -1.754448 -1.598077
H 3.808469 1.741792 -3.204426
H 2.808822 -0.365234 -4.092389
H -3.472249 1.962583 2.553362
H 4.311998 3.226904 -1.223646
H -5.547954 -0.394505 -1.325857
H -5.783593 2.530780 1.823205
H -6.812630 1.366184 -0.097850
H 4.118447 3.618136 1.250551
H 2.922932 1.924350 2.669890


%chk=000291187-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291187

0 1
S 1.457058 -2.320489 0.027802
O 2.736832 -2.900444 0.829082
O 0.687936 -3.242508 -1.071368
N 0.171460 -1.763605 1.396731
N 2.301929 0.433207 1.187962
C 1.965227 -0.739150 -0.925405
C 2.391301 0.411618 -0.197978
C -1.065375 -1.271027 0.904538
C -2.762458 0.515071 0.736497
C 2.886719 1.536859 -0.967659
C -3.664728 -0.410563 0.078790
C -1.458297 0.065782 1.112254
C 1.957416 -0.802809 -2.312029
C -1.966163 -2.190014 0.254709
C -3.223914 -1.759039 -0.152186
C 2.896241 1.462460 -2.398390
C 2.428006 0.324411 -3.058132
C -3.199337 1.862580 0.970217
C 3.343831 2.681245 -0.236482
C -4.963251 0.045834 -0.315595
C -4.471371 2.279897 0.571116
C -5.361910 1.364662 -0.076102
C 3.285941 2.676830 1.158084
C 2.744154 1.533335 1.827603
H 0.749664 -1.041023 1.880225
H -0.764999 0.770514 1.589762
H 1.593763 -1.709145 -2.808269
H -1.638096 -3.221149 0.100443
H -3.906518 -2.460156 -0.646478
H 3.273034 2.317896 -2.971210
H 2.427708 0.279119 -4.151579
H -2.518032 2.562613 1.468918
H 3.732832 3.548642 -0.781819
H -5.644393 -0.657087 -0.810058
H -4.795590 3.310290 0.754145
H -6.357759 1.703725 -0.381773
H 3.632586 3.531318 1.746150
H 2.665551 1.521699 2.920587


