%chk=000280523.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280523

0 1
N -3.954385 0.135825 0.094213
N -5.831594 -1.510682 0.272025
N -6.227750 0.814564 -0.386934
N -4.480673 2.338392 -0.771678
N -7.988394 -0.780266 -0.353614
C -4.380536 -1.329947 0.376757
C -2.542016 0.446434 0.025633
C 2.493528 0.066847 0.015444
C 1.662606 1.352423 -0.126387
C 3.996030 0.365921 -0.035412
C 0.191919 1.043834 -0.074002
C -3.692879 -2.238761 -0.653080
C -3.947892 -1.662801 1.812111
C -4.909832 1.067157 -0.343033
C 4.827965 -0.918736 0.104765
C -1.872456 0.447853 -1.210394
C -1.852532 0.753078 1.209641
C -0.510807 0.744391 -1.252841
C -0.488794 1.044595 1.153333
C -6.625414 -0.529639 -0.122659
C 6.299280 -0.606409 0.054082
C 6.976937 -0.591941 -1.174922
C 7.002098 -0.318996 1.234453
C 8.342056 -0.297248 -1.219695
C 8.367183 -0.024961 1.184002
C 9.040467 -0.013725 -0.041699
H 2.236872 -0.440053 0.966328
H 2.218455 -0.645273 -0.787288
H 1.938430 2.071088 0.672273
H 1.918489 1.865225 -1.076291
H 4.272868 1.076954 0.767707
H 4.253966 0.873254 -0.985880
H -2.603701 -2.229675 -0.558246
H -3.952602 -1.957247 -1.680202
H -4.036399 -3.275051 -0.519893
H -4.346786 -0.940984 2.533568
H -2.860556 -1.699125 1.920310
H -4.348651 -2.646773 2.097737
H 4.556721 -1.636345 -0.696097
H 4.573946 -1.434447 1.053088
H -2.418535 0.221498 -2.126841
H -2.378306 0.758730 2.164195
H 0.010675 0.740909 -2.209704
H 0.049480 1.273638 2.072486
H -5.218279 3.024720 -0.909845
H -3.635866 2.719040 -0.367711
H 6.439467 -0.810092 -2.095179
H 6.484282 -0.324530 2.191051
H -8.373549 -1.607642 0.082152
H -8.601460 0.023746 -0.357332
H 8.863277 -0.288943 -2.175537
H 8.908002 0.195675 2.102787
H 10.103146 0.214201 -0.078643


%chk=000280523-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280523

0 1
N -3.998004 0.070261 -0.018067
N -5.816751 -1.425728 0.769517
N -6.287847 0.808688 -0.137147
N -4.570099 2.257679 -0.752326
N -7.948424 -0.457879 0.899225
C -4.472510 -1.390748 0.175766
C -2.595283 0.397749 -0.102566
C 2.539445 0.090871 0.054981
C 1.680744 1.335320 -0.309188
C 4.055082 0.378487 -0.003628
C 0.188979 1.047170 -0.248511
C -4.497676 -2.084837 -1.215982
C -3.504797 -2.116467 1.129954
C -4.974350 1.016178 -0.302427
C 4.915786 -0.862715 0.364143
C -1.893653 0.291180 -1.332036
C -1.898472 0.845226 1.049278
C -0.519772 0.611367 -1.397800
C -0.526322 1.162574 0.973002
C -6.622315 -0.404585 0.502772
C 6.408477 -0.572448 0.302411
C 7.143001 -0.786091 -0.892759
C 7.091227 -0.036233 1.425281
C 8.518999 -0.471455 -0.967098
C 8.466842 0.280189 1.357198
C 9.186348 0.064509 0.158710
H 2.262615 -0.257032 1.070919
H 2.287478 -0.738525 -0.636630
H 1.940032 2.157260 0.386854
H 1.963536 1.673929 -1.325102
H 4.306153 1.210009 0.685867
H 4.332802 0.723692 -1.020194
H -3.484556 -2.151056 -1.653579
H -5.160322 -1.531968 -1.905791
H -4.897690 -3.106953 -1.098926
H -3.475854 -1.605491 2.107046
H -2.482884 -2.180908 0.717667
H -3.894249 -3.135262 1.290185
H 4.658695 -1.688593 -0.328006
H 4.633553 -1.197797 1.381793
H -2.431057 -0.037576 -2.228273
H -2.446003 0.939084 1.993034
H 0.009570 0.526632 -2.355057
H -0.001109 1.509125 1.871742
H -5.297544 2.956386 -0.878512
H -3.597966 2.464784 -0.963745
H 6.632801 -1.207144 -1.768530
H 6.540710 0.127929 2.360550
H -8.292405 -1.291741 1.365639
H -8.529661 0.364998 0.774322
H 9.070496 -0.647764 -1.897857
H 8.977892 0.689163 2.236469
H 10.253814 0.306259 0.104514


