%chk=000206274.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206274

0 1
N 4.634249 1.078900 0.845439
C 0.777214 0.210778 -1.019826
C 2.285865 0.178415 -0.680689
C -0.074296 1.105994 -0.075801
C -1.122718 0.194651 0.629977
C 2.556587 -0.284207 0.762043
C 2.930642 1.560049 -0.900750
C 0.143221 -1.158198 -0.920767
C -0.936083 -1.164251 -0.005994
C 4.062605 -0.291690 1.065353
C 4.432394 1.521961 -0.574406
C -2.522796 0.739306 0.480887
C 0.490216 -2.314673 -1.606950
C -1.665337 -2.322215 0.226480
C 6.089408 1.090180 1.185245
C -0.247344 -3.487702 -1.370990
C -1.310049 -3.491988 -0.466774
C -3.149995 1.358979 1.571973
C -3.200716 0.648271 -0.745052
C -4.440625 1.879312 1.437027
C -4.490284 1.168062 -0.874810
C -5.113397 1.785158 0.215368
H 0.668192 0.584437 -2.067138
H 2.768305 -0.551072 -1.378758
H -0.570728 1.904018 -0.652469
H 0.555260 1.615215 0.673344
H -0.863761 0.112568 1.715375
H 2.133960 -1.292740 0.926514
H 2.040778 0.387839 1.476834
H 2.437038 2.313814 -0.254914
H 2.785240 1.898288 -1.941719
H 4.222172 -0.555097 2.133575
H 4.569290 -1.073903 0.460694
H 4.964957 0.879749 -1.308061
H 4.856742 2.544950 -0.671256
H 1.314577 -2.319982 -2.314685
H -2.499148 -2.325680 0.924588
H 6.475303 2.116034 1.073165
H 6.714912 0.416551 0.581987
H 6.210490 0.818611 2.246238
H 0.015999 -4.400066 -1.902512
H -1.873383 -4.407012 -0.294849
H -2.634821 1.438403 2.527020
H -2.717221 0.164833 -1.593604
H -4.921997 2.359013 2.287384
H -5.011965 1.091972 -1.827238
H -6.117654 2.189564 0.112404


%chk=000206274-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206274

0 1
N 4.503880 1.166086 0.977761
C 0.894818 0.116415 -1.346943
C 2.333716 0.124104 -0.734072
C -0.133900 1.085632 -0.670364
C -1.013358 0.215713 0.300444
C 2.376801 -0.120907 0.793589
C 3.093486 1.431923 -1.061310
C 0.203212 -1.239146 -1.217000
C -0.879661 -1.184230 -0.304322
C 3.829386 -0.111904 1.310122
C 4.523253 1.405917 -0.484872
C -2.433473 0.744634 0.471446
C 0.532730 -2.451581 -1.858077
C -1.643794 -2.335657 -0.024936
C 5.849012 1.260302 1.575327
C -0.233193 -3.610697 -1.582194
C -1.316365 -3.552596 -0.671069
C -2.824078 1.387980 1.672676
C -3.383013 0.645003 -0.580211
C -4.122820 1.926846 1.821840
C -4.681349 1.179459 -0.435782
C -5.057002 1.825621 0.766187
H 1.018008 0.383568 -2.417304
H 2.888165 -0.712262 -1.217780
H -0.795794 1.516325 -1.444285
H 0.343475 1.929703 -0.142555
H -0.535425 0.205218 1.302137
H 1.902244 -1.088808 1.044428
H 1.819874 0.680513 1.316384
H 2.554618 2.297662 -0.630196
H 3.143351 1.581643 -2.158515
H 3.842045 -0.235378 2.409771
H 4.381141 -0.987987 0.871918
H 5.119026 0.614438 -1.017236
H 5.026010 2.373938 -0.671847
H 1.366011 -2.499557 -2.569917
H -2.487419 -2.286279 0.673249
H 6.282828 2.254283 1.363084
H 6.561192 0.484336 1.192191
H 5.778592 1.144871 2.672069
H 0.007467 -4.556901 -2.080555
H -1.905413 -4.454591 -0.468851
H -2.103402 1.469056 2.496616
H -3.102107 0.137832 -1.511374
H -4.404701 2.421991 2.758180
H -5.401763 1.092159 -1.257440
H -6.065014 2.240709 0.878491


