%chk=000181850.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181850

0 1
N -3.741038 0.341885 0.321667
N 3.048762 0.130642 1.229419
C -1.552835 0.456154 -0.877832
C -0.117261 -0.119739 -0.987748
C -2.339848 -0.220700 0.278576
C -0.194598 -1.642916 -1.216354
C -2.410676 -1.740915 0.008417
C -1.002840 -2.352660 -0.113047
C -1.539210 1.986529 -0.728447
C 0.762406 0.226049 0.228363
C 2.271146 0.055296 -0.064159
C -2.974971 2.509378 -0.643089
C -3.726960 1.832834 0.511605
C -1.094400 -3.857143 -0.395130
C 2.742414 1.189476 -1.004540
C -4.542685 -0.271210 1.426413
C 4.247140 1.115090 -1.275807
C 4.529841 0.036098 0.985103
C 5.004652 1.162047 0.055079
C 2.656896 -0.966847 2.168709
H -2.088428 0.211959 -1.831281
H 0.351640 0.338386 -1.896604
H -1.803058 -0.041057 1.243907
H 0.825910 -2.066372 -1.264724
H -0.652474 -1.843431 -2.202986
H -2.992350 -1.922576 -0.916473
H -2.969366 -2.250665 0.814694
H -0.469072 -2.208552 0.860194
H -1.013919 2.447767 -1.584629
H -0.966140 2.281478 0.173400
H 0.569529 1.266070 0.562087
H 0.467194 -0.404648 1.093081
H 2.436156 -0.930074 -0.573680
H -2.982428 3.605372 -0.503529
H -3.505835 2.311537 -1.596148
H -3.280710 2.137459 1.482822
H -4.783556 2.179222 0.517068
H -1.637707 -4.379932 0.398972
H -1.616389 -4.062521 -1.336308
H -0.100638 -4.311152 -0.466705
H 2.497630 2.169093 -0.547246
H 2.173711 1.137758 -1.951796
H -5.561354 0.147273 1.405642
H -4.126914 -0.127070 2.434069
H -4.642203 -1.353922 1.244295
H 4.559896 1.952960 -1.925743
H 4.495514 0.189445 -1.827879
H 4.831036 -0.948317 0.565677
H 5.034177 0.136824 1.971202
H 6.093397 1.076597 -0.110142
H 4.837185 2.141669 0.546391
H 3.166876 -0.807399 3.131665
H 2.884279 -1.982562 1.814371
H 1.571774 -0.907670 2.365838


%chk=000181850-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181850

0 1
N -3.801064 0.209557 0.374299
N 3.087020 0.451550 1.241159
C -1.614055 0.637755 -0.755364
C -0.140791 0.172629 -0.989320
C -2.375368 -0.244139 0.280050
C -0.150769 -1.317098 -1.424539
C -2.296467 -1.735940 -0.129347
C -0.850245 -2.227858 -0.388018
C -1.727709 2.138811 -0.405953
C 0.789709 0.450172 0.227811
C 2.271186 0.018890 0.057316
C -3.208265 2.548090 -0.284480
C -3.910191 1.645323 0.744468
C -0.846083 -3.703918 -0.841328
C 2.885070 0.617073 -1.234098
C -4.625643 -0.617853 1.282518
C 4.376528 0.260173 -1.402949
C 4.513896 0.049477 1.104249
C 5.164183 0.671957 -0.143229
C 2.548778 -0.021967 2.536086
H -2.148367 0.484087 -1.719541
H 0.233881 0.776592 -1.842215
H -1.880818 -0.125370 1.284328
H 0.878749 -1.680382 -1.609651
H -0.695789 -1.404456 -2.388679
H -2.900643 -1.869788 -1.051192
H -2.747195 -2.376983 0.651745
H -0.288060 -2.164224 0.568324
H -1.210126 2.744475 -1.176420
H -1.222806 2.346840 0.558984
H 0.797534 1.535778 0.445631
H 0.363715 -0.048354 1.117337
H 2.315951 -1.103197 -0.023078
H -3.300967 3.606359 0.028134
H -3.714687 2.438218 -1.262774
H -3.468315 1.838588 1.760013
H -4.985252 1.900466 0.803425
H -1.336450 -4.357209 -0.094816
H -1.389303 -3.820627 -1.799228
H 0.185437 -4.074703 -0.991664
H 2.767752 1.718608 -1.190881
H 2.316639 0.255974 -2.110799
H -5.639959 -0.183623 1.339103
H -4.217467 -0.672865 2.324928
H -4.726620 -1.645554 0.897941
H 4.789755 0.751615 -2.304619
H 4.478922 -0.834585 -1.556843
H 4.616321 -1.068697 1.048213
H 5.048799 0.380286 2.014573
H 6.220371 0.346409 -0.212035
H 5.155825 1.774114 -0.039275
H 3.251383 0.261422 3.340191
H 2.410661 -1.133652 2.577218
H 1.580706 0.454052 2.760992


