%chk=000269729.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269729

0 1
O -3.415482 -0.702351 0.000615
N 2.591709 -1.176320 0.000594
C 0.506775 0.735517 0.000253
C 0.209965 -0.652757 0.000581
C 1.873586 1.144788 0.000134
C -1.137520 -1.096833 0.000711
C -0.573101 1.675476 0.000056
C -2.150283 -0.152969 0.000498
C 2.873625 0.190464 0.000298
C 1.324736 -1.569165 0.000751
C -1.877451 1.248871 0.000179
C 4.321913 0.552677 0.000095
C -4.550179 0.195429 0.000116
H 2.112153 2.204939 -0.000118
H -1.371796 -2.158806 0.000942
H -0.337082 2.740055 -0.000216
H 1.134046 -2.650280 0.001015
H -2.695189 1.964335 0.000037
H 4.587863 1.141105 0.888940
H 4.967598 -0.341667 -0.000801
H 4.587322 1.142585 -0.887919
H -4.555001 0.806042 0.907104
H -5.390946 -0.511770 0.000288
H -4.554760 0.805335 -0.907351


%chk=000269729-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269729

0 1
O -3.473034 -0.729793 0.000580
N 2.631176 -1.178230 0.000606
C 0.518504 0.749648 0.000146
C 0.223710 -0.667914 0.000523
C 1.893003 1.148851 0.000019
C -1.127625 -1.119625 0.000652
C -0.576372 1.671093 -0.000093
C -2.176700 -0.191457 0.000415
C 2.913278 0.188413 0.000253
C 1.345165 -1.568523 0.000739
C -1.897451 1.217794 0.000039
C 4.381734 0.562359 0.000217
C -4.607305 0.197524 0.000262
H 2.147117 2.215528 -0.000267
H -1.359225 -2.190011 0.000936
H -0.369376 2.747719 -0.000383
H 1.166033 -2.652190 0.001013
H -2.716481 1.943319 -0.000143
H 4.648222 1.160777 0.891679
H 4.989213 -0.355970 -0.000853
H 4.647737 1.162667 -0.890105
H -4.610279 0.835178 0.905906
H -5.498347 -0.447114 0.000409
H -4.610198 0.834659 -0.905747


