%chk=000225117.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225117

0 1
N 0.562521 1.305021 0.000064
N -0.562488 -1.305020 0.000084
N 4.984035 -0.763929 -0.000110
N -4.984004 0.763929 -0.000047
C 1.357626 0.202652 0.000030
C -1.357594 -0.202651 0.000045
C 0.783725 -1.121794 0.000108
C -0.783694 1.121794 0.000102
C 2.806724 0.347805 -0.000080
C -2.806692 -0.347805 -0.000054
C 3.610126 -0.823399 -0.000002
C -3.610095 0.823399 0.000034
C 1.652296 -2.289137 0.000232
C -1.652265 2.289138 0.000211
C 2.996275 -2.145925 0.000187
C -2.996245 2.145926 0.000200
C 3.453752 1.606955 -0.000279
C -3.453720 -1.606954 -0.000259
C 4.837060 1.659428 -0.000350
C -4.837028 -1.659429 -0.000361
C 5.570044 0.445978 -0.000288
C -5.570013 -0.445980 -0.000215
H 1.167357 -3.269170 0.000374
H -1.167325 3.269170 0.000331
H 3.674925 -3.004704 0.000304
H -3.674895 3.004704 0.000330
H 2.849438 2.519485 -0.000279
H -2.849407 -2.519485 -0.000335
H 5.363595 2.611575 -0.000435
H -5.363562 -2.611576 -0.000546
H 6.667882 0.454348 -0.000282
H -6.667850 -0.454349 -0.000313


%chk=000225117-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225117

0 1
N 0.576410 1.317526 -0.000018
N -0.576378 -1.317526 -0.000025
N 5.017158 -0.779756 -0.000062
N -5.017126 0.779756 -0.000053
C 1.362529 0.200366 -0.000030
C -1.362498 -0.200366 -0.000029
C 0.780582 -1.132201 -0.000020
C -0.780550 1.132200 -0.000011
C 2.812326 0.344212 -0.000050
C -2.812294 -0.344212 -0.000050
C 3.635298 -0.835481 -0.000041
C -3.635266 0.835481 -0.000038
C 1.644078 -2.291927 -0.000007
C -1.644047 2.291927 0.000009
C 3.017889 -2.148300 -0.000017
C -3.017857 2.148300 -0.000002
C 3.454560 1.614735 -0.000075
C -3.454529 -1.614735 -0.000085
C 4.855877 1.667643 -0.000097
C -4.855846 -1.667643 -0.000106
C 5.592495 0.445745 -0.000098
C -5.592464 -0.445745 -0.000084
H 1.160162 -3.273208 0.000005
H -1.160130 3.273207 0.000025
H 3.694276 -3.008264 -0.000009
H -3.694245 3.008264 0.000011
H 2.835532 2.516481 -0.000077
H -2.835500 -2.516482 -0.000096
H 5.387740 2.624091 -0.000118
H -5.387709 -2.624091 -0.000141
H 6.688738 0.460190 -0.000105
H -6.688707 -0.460189 -0.000104


