%chk=000269720.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269720

0 1
S 2.529666 -2.609668 0.878437
N -1.695114 -0.189343 -1.174577
N 1.100479 -0.878322 -0.478898
C -1.060844 -1.481995 -1.554395
C -0.691133 0.833026 -0.730067
C 0.050185 -1.931755 -0.592174
C 0.756220 0.439983 -1.076992
C -2.903870 -0.232650 -0.404376
C 2.249781 -1.122583 0.190267
C -3.432547 0.967142 0.116803
C -3.639685 -1.429272 -0.259236
C 3.285454 -0.070763 0.307439
C -4.673345 0.966359 0.768644
C -4.872647 -1.412921 0.390002
C -5.396373 -0.227691 0.910237
C 3.432826 0.625318 1.516469
C 4.147532 0.189226 -0.768936
C -5.219034 2.250279 1.307449
C 4.434467 1.592051 1.639216
C 5.148274 1.154917 -0.635442
C 5.289973 1.858850 0.565262
H -0.659790 -1.350273 -2.587182
H -1.829401 -2.287967 -1.632940
H -0.767097 1.027429 0.365398
H -0.945170 1.783679 -1.255757
H -0.361514 -2.148111 0.424193
H 0.512436 -2.885535 -0.949743
H 0.894662 0.382062 -2.182494
H 1.451333 1.230891 -0.711135
H -2.904720 1.907721 -0.002261
H -3.255943 -2.366903 -0.656692
H -5.433952 -2.342071 0.495928
H -6.356177 -0.232513 1.417288
H 2.780250 0.398954 2.360553
H 4.048617 -0.373477 -1.696536
H -4.515682 2.723838 2.006522
H -5.408751 2.969741 0.497693
H -6.166118 2.116194 1.846209
H 4.554085 2.131180 2.578179
H 5.824100 1.353498 -1.466128
H 6.072768 2.609275 0.666673


%chk=000269720-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269720

0 1
S 3.083755 -2.590379 1.168489
N -1.622627 -0.504341 -0.174093
N 1.274927 -0.927776 0.004215
C -0.993920 -1.742044 -0.667142
C -0.713332 0.543423 0.318149
C 0.307603 -2.051838 0.092283
C 0.679062 0.395481 -0.325906
C -3.013093 -0.303800 -0.224755
C 2.569167 -1.114406 0.437321
C -3.621736 0.783928 0.471517
C -3.859546 -1.180092 -0.973304
C 3.558583 -0.011423 0.217399
C -5.018659 1.006499 0.428405
C -5.250055 -0.962424 -1.005512
C -5.838925 0.121986 -0.315218
C 4.442862 0.361651 1.264355
C 3.696036 0.616326 -1.052362
C -5.623373 2.179553 1.184940
C 5.421700 1.355466 1.056100
C 4.692607 1.593481 -1.266225
C 5.552321 1.974459 -0.210320
H -0.796237 -1.701062 -1.761932
H -1.677231 -2.593156 -0.493534
H -0.615310 0.529555 1.426052
H -1.107238 1.538748 0.034591
H 0.095820 -2.268393 1.158066
H 0.788701 -2.958173 -0.317594
H 0.585172 0.513121 -1.423350
H 1.343616 1.191654 0.043393
H -3.008505 1.454858 1.084005
H -3.436765 -2.007869 -1.550584
H -5.881423 -1.643413 -1.588433
H -6.922357 0.280280 -0.352674
H 4.358669 -0.150706 2.228255
H 3.050304 0.309129 -1.883184
H -5.352386 2.151608 2.257124
H -5.264238 3.146212 0.783030
H -6.724635 2.176277 1.115808
H 6.090285 1.639080 1.876296
H 4.801930 2.050252 -2.256135
H 6.322671 2.736070 -0.374638


