%chk=000181241.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181241

0 1
O 5.835506 -0.404783 0.138231
O -0.620553 -0.970697 -0.106187
N -1.935419 0.915102 -0.274858
N 0.452469 1.079732 -0.024306
C -3.174462 0.195168 -0.096125
C 1.805842 0.601863 0.016244
C -0.686430 0.248132 -0.130619
C -2.025080 2.375408 -0.513641
C -3.324325 -1.099739 -0.626249
C -4.237103 0.806993 0.595652
C 2.825236 1.583664 0.024157
C 2.137119 -0.761259 0.052144
C 4.474441 -0.174479 0.099666
C 4.158240 1.199851 0.066643
C 3.476887 -1.154732 0.092495
C -4.539148 -1.767226 -0.469596
C -5.447702 0.124049 0.733377
C -5.605360 -1.158886 0.201988
C 6.281292 -1.780904 0.178117
H 0.345190 2.090844 0.031674
H -3.020417 2.637946 -0.918719
H -1.291192 2.692435 -1.275099
H -1.872648 2.953296 0.413318
H -2.488275 -1.586409 -1.136116
H -4.123069 1.792864 1.037618
H 2.575787 2.642691 -0.002713
H 1.349585 -1.525962 0.049606
H 4.961814 1.933754 0.074491
H 3.719288 -2.213171 0.118944
H -4.654965 -2.771835 -0.876355
H -6.272041 0.596288 1.266573
H -6.550212 -1.685001 0.314894
H 5.966200 -2.309791 -0.725897
H 5.919863 -2.272301 1.085967
H 7.372340 -1.662005 0.203581


%chk=000181241-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181241

0 1
O 5.951409 -0.291691 0.159038
O -0.646785 -1.158510 -0.077186
N -1.933514 0.820762 -0.251329
N 0.417834 0.931169 -0.013573
C -3.208096 0.162940 -0.093252
C 1.785694 0.524612 0.029265
C -0.711885 0.106994 -0.113788
C -1.935301 2.278483 -0.496664
C -3.438111 -1.159106 -0.561663
C -4.276932 0.873481 0.518955
C 2.763188 1.557321 0.104342
C 2.215928 -0.824992 0.001342
C 4.558984 -0.097150 0.113192
C 4.132846 1.253816 0.147395
C 3.595202 -1.130600 0.039938
C -4.713755 -1.744167 -0.414907
C -5.551325 0.280895 0.649125
C -5.779411 -1.033119 0.183453
C 6.434969 -1.672815 0.129435
H 0.274270 1.935310 0.093984
H -2.914507 2.571193 -0.904522
H -1.177234 2.539353 -1.257638
H -1.755944 2.878979 0.420233
H -2.619688 -1.718309 -1.015538
H -4.112668 1.879790 0.919395
H 2.448566 2.609365 0.126816
H 1.470560 -1.620370 -0.042362
H 4.887053 2.044155 0.205345
H 3.896650 -2.182232 0.017053
H -4.874563 -2.764508 -0.781041
H -6.360186 0.845139 1.127005
H -6.766923 -1.495350 0.287605
H 6.134035 -2.186168 -0.804977
H 6.066925 -2.248311 1.001499
H 7.531411 -1.595457 0.172924


