%chk=000219867.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219867

0 1
N -1.906303 -0.651802 0.470200
N 2.803910 -0.558521 0.395050
N -0.819274 1.067197 -0.771922
N 1.618517 1.236629 -0.909005
N 2.390944 -1.625921 1.178533
C -3.235817 -0.145535 0.195261
C -3.918232 0.560556 1.210961
C -3.839740 -0.392620 -1.056106
C -0.749305 -0.041601 0.040665
C 0.525750 -0.559378 0.413729
C -3.277961 0.858702 2.540467
C -3.130379 -1.125807 -2.162232
C 1.682131 0.131553 -0.100984
C -5.230791 0.987774 0.969167
C -5.153943 0.054324 -1.264005
C -5.842987 0.735578 -0.260231
C 1.046876 -1.642217 1.201022
C -3.539818 -0.258304 3.549559
C -3.235400 -2.639677 -1.984573
C 4.208843 -0.304014 0.192878
C 0.349624 1.651373 -1.207079
C 4.622824 0.826468 -0.530870
C 5.155294 -1.199553 0.729196
C 0.211350 2.850419 -2.083597
C 5.989159 1.052607 -0.714632
C 6.513801 -0.952239 0.533720
C 6.936026 0.170691 -0.186809
H -1.846536 -1.418970 1.134955
H -2.186587 1.025601 2.424013
H -3.664806 1.821064 2.938761
H -3.550201 -0.832459 -3.147055
H -2.064001 -0.816715 -2.209775
H -5.774395 1.525099 1.744367
H -5.639076 -0.132478 -2.220915
H -6.862772 1.075819 -0.437427
H 0.485343 -2.383958 1.746277
H -4.615039 -0.399528 3.717989
H -3.081945 -0.028876 4.519026
H -3.136831 -1.218549 3.212201
H -2.757907 -2.969636 -1.055200
H -2.746030 -3.167310 -2.811400
H -4.280801 -2.968830 -1.952870
H 3.897043 1.528973 -0.953249
H 4.831612 -2.077117 1.292825
H 0.697323 3.728713 -1.629283
H 0.696009 2.684687 -3.058895
H -0.845518 3.105382 -2.267048
H 6.313606 1.928356 -1.276518
H 7.249601 -1.641748 0.946744
H 7.997709 0.355700 -0.335087


%chk=000219867-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000219867

0 1
N -1.932306 -0.524819 0.506908
N 2.781680 -0.516464 0.414934
N -0.804658 1.016549 -0.902008
N 1.637545 1.149674 -1.034159
N 2.384864 -1.537249 1.304709
C -3.272920 -0.051524 0.233742
C -3.996416 0.541620 1.309580
C -3.858480 -0.225160 -1.053392
C -0.755242 -0.003670 0.006717
C 0.515918 -0.514006 0.431084
C -3.374291 0.710235 2.689567
C -3.131372 -0.923282 -2.192651
C 1.667508 0.122333 -0.133852
C -5.325900 0.969638 1.076993
C -5.184207 0.236177 -1.246083
C -5.918438 0.825281 -0.194553
C 1.030874 -1.525696 1.305871
C -3.528597 -0.549560 3.585978
C -3.056761 -2.462845 -2.010895
C 4.182749 -0.284903 0.207047
C 0.373803 1.543025 -1.378237
C 4.619572 0.737174 -0.673268
C 5.120933 -1.093349 0.896443
C 0.259378 2.668484 -2.377151
C 6.004276 0.941077 -0.855153
C 6.499526 -0.873395 0.700435
C 6.951238 0.142693 -0.174289
H -1.832574 -1.195987 1.271054
H -2.302020 0.965074 2.594961
H -3.857611 1.563164 3.200791
H -3.660181 -0.702016 -3.138974
H -2.113560 -0.508924 -2.296506
H -5.887407 1.434159 1.896476
H -5.643945 0.119731 -2.234773
H -6.943092 1.172713 -0.367374
H 0.506496 -2.248775 1.929586
H -4.594922 -0.799321 3.730023
H -3.074433 -0.383739 4.579758
H -3.044361 -1.440664 3.140792
H -2.504254 -2.727940 -1.091894
H -2.534965 -2.929944 -2.866139
H -4.067418 -2.904805 -1.941717
H 3.881038 1.349548 -1.196006
H 4.759387 -1.874309 1.568654
H 0.765345 3.573099 -1.994976
H 0.760383 2.395634 -3.323233
H -0.799035 2.894739 -2.571183
H 6.340943 1.731409 -1.535343
H 7.222922 -1.499541 1.234407
H 8.023888 0.308560 -0.321898


