%chk=000262066.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262066

0 1
S 1.039152 -1.152477 0.883084
O 0.169156 0.063109 0.023571
O 0.549788 -2.409039 0.384778
O 0.914682 -0.800842 2.267674
N -4.870960 -2.976873 -0.509767
C -0.919226 2.607554 0.459757
C -1.778886 1.395433 0.256396
C -0.662749 3.330423 -0.873504
C -1.203870 0.114704 0.074358
C -3.175029 1.493696 0.230756
C -1.982471 -1.030245 -0.124541
C 0.169862 4.593644 -0.676514
C 2.596846 -0.787643 0.270284
C -3.977005 0.365069 0.038123
C -3.378180 -0.891238 -0.138768
C 3.424360 0.110274 0.956386
C 3.038354 -1.388048 -0.915432
C 4.694185 0.407827 0.455928
C 4.308621 -1.089636 -1.415293
C 5.134435 -0.191254 -0.730171
C -4.202606 -2.048305 -0.343142
H -1.390957 3.299115 1.186393
H 0.050590 2.311426 0.915490
H -0.146202 2.639810 -1.570775
H -1.626963 3.583998 -1.355784
H -3.645770 2.468689 0.366564
H -1.517392 -2.013698 -0.268412
H -0.331411 5.311959 -0.017709
H 1.147102 4.369389 -0.234063
H 0.351725 5.098643 -1.632359
H -5.062520 0.461487 0.026181
H 3.081695 0.574834 1.888361
H 2.394162 -2.096298 -1.449599
H 5.340445 1.104935 0.988846
H 4.654379 -1.556478 -2.337514
H 6.126359 0.042555 -1.121682


%chk=000262066-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262066

0 1
S 1.176400 -0.529501 1.176950
O 0.121485 0.273657 -0.354381
O 0.597639 -2.025215 1.435559
O 1.276154 0.544473 2.393261
N -4.679071 -3.146027 -1.271312
C -1.206694 2.642676 0.663734
C -1.958472 1.392364 0.259183
C -0.719214 3.464838 -0.566295
C -1.258205 0.231119 -0.210957
C -3.372755 1.331594 0.285225
C -1.949462 -0.947926 -0.589776
C 0.042500 4.736906 -0.140971
C 2.817224 -0.613921 0.271332
C -4.075600 0.173271 -0.104981
C -3.364192 -0.980480 -0.543496
C 3.700420 0.467724 0.418434
C 3.083168 -1.759064 -0.496866
C 4.940575 0.386423 -0.255930
C 4.329664 -1.817122 -1.161361
C 5.249462 -0.747893 -1.043498
C -4.080448 -2.165213 -0.939564
H -1.859605 3.281411 1.288701
H -0.326530 2.371683 1.276034
H -0.066903 2.819866 -1.184477
H -1.590075 3.738570 -1.194046
H -3.933190 2.208082 0.629283
H -1.375856 -1.819044 -0.918282
H -0.598056 5.404478 0.465794
H 0.931417 4.482311 0.466218
H 0.385882 5.308449 -1.022505
H -5.169134 0.148662 -0.066899
H 3.437604 1.324718 1.046177
H 2.357928 -2.576266 -0.558235
H 5.659706 1.206531 -0.164057
H 4.577817 -2.694287 -1.767238
H 6.212116 -0.801350 -1.562857


