%chk=000209270.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209270

2 1
N 0.224238 -2.113701 0.399199
N -3.873348 1.006209 0.420360
C 2.524956 -2.861497 -0.540381
C 2.627649 -1.408364 -0.016126
C 1.216876 -0.946297 0.445593
C 0.068206 -2.586910 -1.054708
C 0.788862 -3.282004 1.237536
C 1.445419 -2.959470 -1.632754
C 2.116746 -3.769310 0.634038
C -1.127766 -1.711137 0.992933
C 3.220391 -0.449634 -1.059663
C -1.792803 -0.506357 0.306504
C -3.140144 -0.210381 0.984467
C -5.233784 1.171675 1.136140
C -4.230170 0.832976 -1.066693
C 3.197363 0.984845 -0.599934
C -6.174361 1.808667 0.108358
C -5.548060 1.590226 -1.277378
C -3.052347 2.259892 0.615445
C 2.416576 1.927837 -1.284244
C 3.972543 1.387847 0.497984
C 2.417264 3.265108 -0.873786
C 3.964509 2.724027 0.906515
C 3.184622 3.664261 0.223987
H 3.511526 -3.189931 -0.951311
H 3.305965 -1.400485 0.877576
H 0.853274 -0.121168 -0.206961
H 1.273974 -0.540778 1.478706
H -0.401139 -1.782687 -1.659567
H -0.615267 -3.465245 -1.082225
H 0.940171 -2.938950 2.285751
H 0.047241 -4.111032 1.265962
H 1.703379 -2.300604 -2.488806
H 1.420792 -3.984857 -2.060019
H 2.030813 -4.824161 0.295880
H 2.911632 -3.790940 1.410077
H -0.979839 -1.490979 2.080719
H -1.808311 -2.598334 0.950061
H 4.277256 -0.741203 -1.271222
H 2.709668 -0.557999 -2.038224
H -1.937149 -0.709527 -0.777059
H -1.126600 0.384240 0.362932
H -3.814737 -1.099881 0.895711
H -2.989119 -0.048751 2.082213
H -5.618733 0.178655 1.460560
H -5.127032 1.790301 2.053902
H -3.419951 1.219597 -1.719325
H -4.359650 -0.246951 -1.300576
H -7.189972 1.359316 0.168779
H -6.335229 2.888445 0.310131
H -5.388730 2.556221 -1.800024
H -6.231463 1.019296 -1.942689
H -2.804348 2.434645 1.679636
H -2.107436 2.240406 0.045411
H -3.612727 3.157220 0.269994
H 1.850624 1.639439 -2.166102
H 4.609834 0.672524 1.016281
H 1.838380 4.004737 -1.427726
H 4.583657 3.039649 1.749564
H 3.197314 4.710863 0.533696


%chk=000209270-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209270

2 1
N 0.230045 -2.088826 0.323407
N -3.969676 0.981792 0.392922
C 2.545633 -2.895107 -0.585546
C 2.654628 -1.427741 -0.076871
C 1.210201 -0.900649 0.171487
C 0.063832 -2.767584 -1.056627
C 0.874063 -3.129240 1.286377
C 1.463301 -2.994499 -1.692226
C 2.102780 -3.786321 0.604121
C -1.116617 -1.656952 0.918262
C 3.428556 -0.467385 -1.023781
C -1.805732 -0.456237 0.224178
C -3.131411 -0.170640 0.968760
C -5.290260 1.136611 1.207045
C -4.499203 0.696503 -1.036324
C 3.390228 0.981368 -0.542492
C -6.267131 1.867177 0.259906
C -5.744948 1.597181 -1.192403
C -3.201924 2.301981 0.425902
C 2.708291 1.976648 -1.288540
C 4.034924 1.358140 0.665721
C 2.670537 3.318757 -0.840857
C 3.995606 2.695511 1.117835
C 3.309958 3.680157 0.366866
H 3.518531 -3.234804 -0.976676
H 3.193437 -1.442191 0.890665
H 0.857875 -0.298896 -0.683977
H 1.144089 -0.288593 1.086978
H -0.570508 -2.114999 -1.678188
H -0.474159 -3.713198 -0.871123
H 1.147332 -2.568686 2.196549
H 0.090358 -3.862179 1.542950
H 1.651734 -2.258934 -2.492144
H 1.486541 -3.991814 -2.162758
H 1.859477 -4.804368 0.253578
H 2.915299 -3.882761 1.344002
H -0.916431 -1.417164 1.978669
H -1.767630 -2.550064 0.887816
H 4.473838 -0.825801 -1.085786
H 3.010518 -0.529616 -2.047173
H -2.011652 -0.686310 -0.836631
H -1.145340 0.426595 0.263615
H -3.785604 -1.061037 0.950994
H -2.936020 0.088629 2.025417
H -5.633961 0.116014 1.446053
H -5.069084 1.672966 2.143452
H -3.703725 0.898899 -1.770001
H -4.763605 -0.374753 -1.064492
H -7.286685 1.476863 0.404598
H -6.306055 2.947185 0.473211
H -5.496602 2.539676 -1.706153
H -6.500870 1.086599 -1.809494
H -2.830934 2.477510 1.447569
H -2.363441 2.266061 -0.284393
H -3.880939 3.117084 0.138799
H 2.251288 1.714078 -2.252170
H 4.604731 0.614459 1.237796
H 2.173719 4.084478 -1.446703
H 4.518707 2.976553 2.037939
H 3.301596 4.721474 0.705187


