%chk=000248869.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248869

0 1
O 2.167935 0.947400 0.413828
O 2.957849 -2.053672 -0.918562
O 5.488058 -0.309108 1.192810
N 0.189209 0.103312 -0.561713
N -1.247078 -1.594257 0.039731
N -1.465370 1.993646 -0.585494
N -3.733159 1.263096 -0.007075
N -4.249698 -1.019011 0.488996
C 1.445133 0.831135 -0.825467
C 3.368356 -0.677334 -0.902596
C 2.359214 0.060372 -1.793466
C 3.177403 -0.091395 0.521861
C 4.408348 0.625729 1.095966
C -1.077249 0.689057 -0.406764
C 0.017327 -1.295206 -0.258256
C -1.961274 -0.382837 -0.042853
C -3.339208 -0.054034 0.159118
C -2.794381 2.192328 -0.366003
C -5.670484 -0.725887 0.751115
H 1.209801 1.888975 -1.106661
H 4.409565 -0.614384 -1.272332
H 2.859635 0.749873 -2.495334
H 1.802083 -0.663434 -2.427330
H 2.781417 -0.857066 1.224443
H 4.226275 0.935190 2.146060
H 4.690753 1.511854 0.505074
H 0.861505 -1.981407 -0.304831
H 3.592024 -2.612049 -0.419557
H 6.025522 -0.303016 0.376689
H -3.167211 3.223877 -0.488555
H -3.925593 -1.972771 0.639521
H -5.982680 0.224528 0.271463
H -5.859083 -0.622228 1.834531
H -6.302544 -1.534276 0.348643


%chk=000248869-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248869

0 1
O 2.190505 1.224756 0.088119
O 3.179225 -2.044674 -0.981292
O 5.085615 -0.712002 1.283786
N 0.171095 0.106584 -0.722085
N -1.221786 -1.598240 -0.061922
N -1.443038 2.001092 -0.621217
N -3.680712 1.263743 0.095803
N -4.168232 -1.012266 0.619175
C 1.379350 0.857478 -1.094350
C 3.374290 -0.588888 -1.012649
C 2.349852 0.047093 -1.987468
C 3.052646 0.059276 0.369158
C 4.286184 0.522710 1.134131
C -1.081592 0.692317 -0.479165
C 0.024724 -1.271958 -0.451103
C -1.921724 -0.375287 -0.076645
C -3.280661 -0.047105 0.220722
C -2.760762 2.192210 -0.312210
C -5.573403 -0.753970 0.943201
H 1.032581 1.811904 -1.518225
H 4.414024 -0.361253 -1.315151
H 2.853424 0.741577 -2.678193
H 1.844032 -0.728312 -2.583871
H 2.498628 -0.683611 0.980236
H 4.000246 0.942771 2.117936
H 4.836545 1.290384 0.552931
H 0.853582 -1.969507 -0.572761
H 3.832877 -2.415883 -0.333517
H 5.866187 -0.543686 1.865607
H -3.132048 3.217780 -0.400461
H -3.795741 -1.961642 0.684946
H -5.757989 0.322126 0.803297
H -5.797369 -1.023814 1.992510
H -6.248155 -1.324702 0.277726


