%chk=000218727.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218727

0 1
O 0.661837 1.493567 -0.333147
O -2.992865 -1.801958 0.240201
O -7.106246 1.048404 -0.013655
O -5.598670 2.231509 1.143253
N -1.204109 -0.366148 -0.070984
C -0.130608 -1.293760 -0.104830
C 1.205385 -0.807445 -0.176144
C -3.461612 0.562950 0.106587
C 1.522103 0.636643 -0.173535
C -2.575550 -0.670053 0.100292
C -0.368139 -2.688283 -0.075797
C 2.255295 -1.747351 -0.269431
C 2.944394 1.058663 0.038420
C -4.930516 0.162122 -0.009618
C 0.690157 -3.579764 -0.151276
C 2.012082 -3.112467 -0.258344
C 3.605239 0.738690 1.232482
C 3.588293 1.820419 -0.945093
C 4.917182 1.174282 1.435036
C 4.904645 2.244897 -0.740563
C -5.830199 1.264815 0.457212
C 5.567949 1.922979 0.447805
H -3.293866 1.137737 1.050894
H -3.189213 1.268096 -0.707881
H -0.932310 0.642894 -0.184815
H -1.395981 -3.065415 0.003240
H 3.285328 -1.389486 -0.358778
H -5.186338 -0.139366 -1.050785
H -5.133495 -0.761963 0.592366
H 0.496901 -4.654292 -0.132353
H 2.833967 -3.820864 -0.332009
H 3.095284 0.157732 2.001465
H 3.060309 2.085918 -1.861846
H 5.432493 0.932448 2.363601
H 5.409816 2.833286 -1.505444
H 6.592010 2.259268 0.607569
H -7.750456 1.744795 0.286303


%chk=000218727-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218727

0 1
O 0.604863 1.319529 -0.557898
O -3.077165 -1.840327 0.466090
O -7.004042 1.337581 -0.318361
O -5.515900 2.254253 1.207676
N -1.187045 -0.517213 -0.021037
C -0.141618 -1.463530 -0.012682
C 1.218647 -0.988952 -0.165943
C -3.364742 0.582342 0.186648
C 1.526209 0.462766 -0.274813
C -2.546663 -0.715039 0.216304
C -0.385177 -2.857923 0.132005
C 2.264729 -1.953991 -0.256906
C 2.912225 0.991326 -0.042476
C -4.836205 0.307006 -0.165395
C 0.681200 -3.773146 0.067158
C 2.009765 -3.330964 -0.148322
C 3.773914 0.476146 0.964288
C 3.323880 2.126117 -0.792545
C 5.030012 1.076286 1.199729
C 4.586786 2.709685 -0.570462
C -5.760376 1.398469 0.327643
C 5.444712 2.185311 0.426510
H -3.320119 1.043207 1.193771
H -2.915942 1.315883 -0.507843
H -0.852293 0.440683 -0.264118
H -1.413208 -3.193697 0.277945
H 3.284815 -1.608175 -0.446467
H -4.988044 0.164299 -1.249063
H -5.139029 -0.647529 0.311264
H 0.469918 -4.843737 0.166364
H 2.828853 -4.051709 -0.234825
H 3.447387 -0.363288 1.586650
H 2.636731 2.537869 -1.538700
H 5.679861 0.683957 1.989412
H 4.900957 3.574472 -1.164664
H 6.423196 2.644367 0.606288
H -7.600598 2.041163 0.057172


