%chk=000254324.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254324

0 1
N 1.855697 0.998893 0.394794
N -1.794704 1.109272 0.424487
N -0.065060 -2.107778 0.397320
C -0.012943 0.005933 -1.036204
C 1.423849 0.099613 -0.609149
C -0.808719 1.197780 -0.586997
C -0.643530 -1.284845 -0.598279
C 2.512839 -0.637235 -1.068654
C -0.718827 2.515093 -1.030382
C -1.833238 -1.859774 -1.038813
C 3.676765 -0.177724 -0.348716
C -1.692419 3.284046 -0.292098
C -2.006051 -3.096956 -0.315138
C 3.240011 0.853675 0.550567
C -2.359649 2.378634 0.601368
C -0.880535 -3.233827 0.566749
C 2.502047 -1.691768 -2.102624
C 0.190950 3.046264 -2.065490
C -2.757096 -1.323921 -2.058934
C 5.039939 -0.531047 -0.372058
C -2.067970 4.641455 -0.294716
C -2.993919 -4.100801 -0.322297
C 4.136407 1.524543 1.410383
C -3.381328 2.808430 1.475604
C -0.734362 -4.344934 1.425205
C 5.914764 0.128172 0.472514
C -3.068927 5.058598 0.563941
C -2.847284 -5.187414 0.520885
C 5.464806 1.147483 1.355244
C -3.719236 4.148010 1.440616
C -1.725890 -5.306813 1.386270
H -0.021955 0.010469 -2.171094
H 1.273494 1.693248 0.830935
H -2.101655 0.252296 0.851909
H 0.834027 -1.950431 0.819445
H 2.778603 -1.282574 -3.086383
H 3.219878 -2.492132 -1.872380
H 1.514207 -2.164199 -2.207663
H 0.527049 4.065170 -1.825160
H 1.093145 2.428549 -2.186031
H -0.310061 3.093566 -3.044492
H -3.805459 -1.544917 -1.811992
H -2.673731 -0.232332 -2.166359
H -2.556589 -1.769034 -3.045528
H 5.383497 -1.309283 -1.049656
H -1.571515 5.336765 -0.967688
H -3.850151 -4.009668 -0.986659
H 3.787427 2.302333 2.080809
H -3.874762 2.108768 2.141343
H 0.124082 -4.431157 2.082359
H 6.972255 -0.126700 0.471491
H -3.376750 6.101799 0.579010
H -3.596717 -5.975749 0.532169
H 6.195591 1.636587 1.998487
H -4.502598 4.528042 2.095560
H -1.657697 -6.183774 2.029170


%chk=000254324-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254324

0 1
N 1.861525 0.991644 0.330708
N -1.845773 1.116859 0.316724
N -0.054958 -2.125786 0.319874
C -0.021592 0.005300 -1.087947
C 1.441713 0.091394 -0.664868
C -0.819971 1.226293 -0.638676
C -0.669152 -1.302164 -0.639665
C 2.541979 -0.656436 -1.105707
C -0.689960 2.567194 -1.026132
C -1.887258 -1.876211 -1.029914
C 3.693135 -0.184896 -0.352842
C -1.688904 3.313818 -0.278938
C -2.022566 -3.113677 -0.278519
C 3.236809 0.854661 0.534918
C -2.403636 2.376221 0.550131
C -0.854312 -3.246908 0.554688
C 2.546485 -1.733825 -2.160449
C 0.280221 3.134103 -2.031657
C -2.863625 -1.337622 -2.045094
C 5.068095 -0.541420 -0.346589
C -2.050335 4.686842 -0.234926
C -3.018458 -4.125877 -0.234214
C 4.109369 1.537901 1.409926
C -3.456391 2.772335 1.403744
C -0.659485 -4.351040 1.412834
C 5.943024 0.135652 0.525265
C -3.098947 5.088018 0.615703
C -2.830313 -5.229121 0.621130
C 5.469084 1.164700 1.393188
C -3.794851 4.141005 1.425473
C -1.663258 -5.341064 1.434995
H -0.034003 0.005467 -2.197318
H 1.248406 1.699401 0.735994
H -2.171313 0.222103 0.683753
H 0.878427 -1.948012 0.691150
H 3.198826 -1.459670 -3.011843
H 2.925175 -2.694473 -1.761183
H 1.534646 -1.922849 -2.558678
H 0.898947 3.939645 -1.591472
H 0.971224 2.362960 -2.413348
H -0.249761 3.572691 -2.899110
H -3.875281 -1.212388 -1.613259
H -2.549856 -0.353274 -2.432968
H -2.965604 -2.023893 -2.907854
H 5.443777 -1.328894 -1.009770
H -1.524367 5.422545 -0.853966
H -3.917384 -4.051997 -0.856790
H 3.750018 2.327373 2.079219
H -3.993180 2.049596 2.028178
H 0.234035 -4.440696 2.040512
H 7.006634 -0.127419 0.541600
H -3.390220 6.143442 0.660313
H -3.589053 -6.018457 0.665989
H 6.175293 1.672966 2.059209
H -4.606628 4.484847 2.076208
H -1.546453 -6.212212 2.089269


