%chk=000217770.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217770

0 1
N -3.295467 -1.767613 0.452514
C 0.062872 -0.212423 -0.278153
C -2.334264 -0.743465 -0.087384
C -1.011196 -0.740277 0.713068
C -0.421997 -0.728899 -1.666899
C -1.909574 -1.094553 -1.536687
C 1.466889 -0.759398 -0.044391
C 0.077185 1.311025 -0.154926
C 1.725993 -1.803469 0.852069
C 0.815590 1.906359 0.884079
C 2.534319 -0.217905 -0.784423
C -0.667294 2.133278 -1.011059
C -4.564321 -1.771339 -0.339817
C -3.611497 -1.503764 1.890223
C 3.026028 -2.293143 1.016262
C 0.820262 3.292036 1.048626
C 3.830438 -0.707672 -0.620643
C -0.661521 3.522488 -0.845007
C 4.081390 -1.747215 0.282537
C 0.082253 4.106593 0.182437
H -2.774776 0.285625 -0.069489
H -1.074289 -0.122245 1.620816
H -0.768356 -1.771069 1.042122
H 0.161024 -1.621536 -1.961638
H -0.246330 0.014439 -2.460387
H -2.527266 -0.559443 -2.273313
H -2.052301 -2.175475 -1.727883
H 0.908667 -2.248425 1.423244
H 1.395029 1.281747 1.564430
H 2.347242 0.595038 -1.485651
H -1.261283 1.697459 -1.813348
H -5.247283 -2.528098 0.078313
H -4.346392 -2.080760 -1.373791
H -5.093230 -0.807813 -0.369026
H -4.363089 -2.230532 2.237205
H -3.986579 -0.492155 2.102532
H -2.706701 -1.674611 2.494374
H 3.212234 -3.104340 1.717879
H 1.400248 3.740200 1.853512
H 4.648803 -0.279518 -1.196849
H -1.241482 4.148558 -1.520564
H 5.092133 -2.127521 0.410137
H 0.087791 5.186334 0.310251


%chk=000217770-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217770

0 1
N -3.382027 -1.675369 0.413068
C 0.095632 -0.331541 -0.309847
C -2.316840 -0.747825 -0.060193
C -0.960016 -0.963648 0.653741
C -0.428038 -0.858537 -1.691153
C -1.980553 -0.953206 -1.572948
C 1.542763 -0.801440 -0.061337
C 0.035156 1.213854 -0.177045
C 1.905905 -1.651263 1.013040
C 0.589507 1.822211 0.982268
C 2.567389 -0.370667 -0.947813
C -0.575321 2.057345 -1.138588
C -4.661334 -1.441066 -0.295515
C -3.584861 -1.609988 1.877973
C 3.246791 -2.066445 1.192833
C 0.531929 3.217560 1.177209
C 3.904061 -0.785631 -0.776464
C -0.630846 3.458942 -0.951432
C 4.251735 -1.639176 0.298063
C -0.080419 4.047016 0.207822
H -2.636036 0.314624 0.103818
H -0.920887 -0.522459 1.664676
H -0.787531 -2.055133 0.733277
H -0.002402 -1.865324 -1.850115
H -0.093167 -0.235455 -2.539343
H -2.491907 -0.206313 -2.206293
H -2.327762 -1.955054 -1.883997
H 1.145414 -1.994489 1.721781
H 1.086068 1.193086 1.730839
H 2.312242 0.305855 -1.772542
H -1.013689 1.631630 -2.046970
H -5.410021 -2.179507 0.043242
H -4.526015 -1.569773 -1.382223
H -5.079297 -0.416267 -0.118466
H -4.385321 -2.315133 2.165621
H -3.875986 -0.589648 2.238533
H -2.665209 -1.911076 2.406072
H 3.503712 -2.722245 2.032885
H 0.970818 3.659646 2.079133
H 4.675348 -0.441482 -1.475153
H -1.106317 4.088547 -1.712595
H 5.290106 -1.960943 0.436151
H -0.122870 5.132291 0.353288


