%chk=000222028.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222028

0 1
N 1.199721 0.046994 -0.271471
N -1.197849 -0.018365 0.267712
C 2.341020 0.874177 -0.761632
C -2.384506 0.747743 0.749360
C -0.023678 0.880228 -0.006394
C 2.098563 1.338705 -2.232541
C -2.169408 1.240842 2.215216
C 1.572123 -0.796794 0.910885
C -1.521243 -0.894373 -0.905599
C 2.247982 2.877669 -2.228852
C -2.406284 2.768665 2.195308
C 2.600648 2.166774 0.002750
C -2.716944 2.015323 -0.028599
C 2.443414 -1.975338 0.443756
C -2.324397 -2.115499 -0.425896
C 2.557418 3.238204 -0.796368
C -2.735111 3.095857 0.759144
C 2.785783 -2.906120 1.613678
C -2.612870 -3.076512 -1.585865
C 3.655226 -4.078695 1.164527
C -3.414503 -4.291769 -1.124201
H 3.260959 0.233365 -0.725187
H -3.266516 0.055315 0.719921
H 0.103680 1.549867 0.877925
H -0.188617 1.532323 -0.897583
H 2.829086 0.865304 -2.905493
H 1.105050 1.026976 -2.594782
H -2.871978 0.733708 2.893334
H -1.159860 0.990092 2.580456
H 2.089345 -0.218372 1.703660
H 0.632385 -1.192372 1.365024
H -0.560368 -1.240718 -1.355709
H -2.070140 -0.354657 -1.704350
H 3.055811 3.206729 -2.905563
H 1.326535 3.377807 -2.574379
H -3.231871 3.058265 2.868618
H -1.515001 3.324120 2.535415
H 2.795539 2.139176 1.059549
H -2.909487 1.965519 -1.085015
H 1.907525 -2.534765 -0.348838
H 3.370975 -1.603037 -0.032694
H -3.271801 -1.791467 0.046767
H -1.757935 -2.635199 0.372461
H 2.715996 4.268116 -0.522821
H -2.951930 4.112127 0.474755
H 3.306503 -2.338676 2.409443
H 1.853462 -3.288609 2.074458
H -3.164648 -2.547981 -2.387477
H -1.660143 -3.410273 -2.042759
H 4.605224 -3.736895 0.738651
H 3.890249 -4.742131 2.003976
H 3.152468 -4.681764 0.399596
H -4.382553 -4.000001 -0.701776
H -3.611125 -4.976299 -1.956557
H -2.878622 -4.857211 -0.353043


%chk=000222028-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000222028

0 1
N 1.191153 0.138346 -0.198591
N -1.200297 0.074647 0.203026
C 2.314390 0.835555 -0.895076
C -2.362001 0.719557 0.887668
C -0.027416 0.953245 -0.001573
C 1.997530 1.222230 -2.383864
C -2.071929 1.142370 2.371786
C 1.593629 -0.647055 0.995250
C -1.558812 -0.740459 -0.985292
C 1.968817 2.782588 -2.463452
C -2.123902 2.703216 2.429297
C 2.721449 2.177401 -0.271674
C -2.837586 2.029311 0.244742
C 2.241716 -2.001887 0.636152
C -2.122095 -2.130372 -0.617013
C 2.514273 3.223690 -1.112378
C -2.687653 3.096537 1.070966
C 2.659684 -2.809284 1.886767
C -2.497846 -2.966002 -1.862505
C 3.309625 -4.164662 1.533773
C -3.043119 -4.364994 -1.502255
H 3.160972 0.124097 -0.864538
H -3.169182 -0.036521 0.863628
H 0.038758 1.627036 0.882720
H -0.130954 1.614095 -0.891989
H 2.792196 0.826828 -3.040658
H 1.049635 0.758707 -2.706141
H -2.848194 0.715910 3.031164
H -1.102893 0.732984 2.704591
H 2.283301 -0.071917 1.662803
H 0.666813 -0.842394 1.566414
H -0.624660 -0.882899 -1.559960
H -2.284510 -0.211178 -1.652429
H 2.586039 3.164772 -3.299264
H 0.945780 3.181912 -2.622545
H -2.762439 3.064784 3.258257
H -1.123144 3.156710 2.585097
H 3.095152 2.257615 0.755363
H -3.212337 2.075506 -0.784033
H 1.517633 -2.584007 0.032591
H 3.132632 -1.846663 -0.006588
H -3.016258 -2.026493 0.031467
H -1.360134 -2.665671 -0.016814
H 2.693275 4.277141 -0.867416
H -2.920896 4.135659 0.810939
H 3.366821 -2.206610 2.493576
H 1.769377 -2.979855 2.526051
H -3.254472 -2.416128 -2.459608
H -1.605798 -3.071875 -2.513363
H 4.217334 -4.018883 0.917803
H 3.602618 -4.724070 2.441427
H 2.612046 -4.799156 0.955162
H -3.951830 -4.286134 -0.875807
H -3.304836 -4.944814 -2.406675
H -2.294154 -4.946366 -0.932082


