%chk=000189238.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189238

0 1
O 4.541077 0.470554 0.000728
O 4.515163 -1.692978 0.000383
N 3.960318 -0.602939 0.000040
C 0.333537 0.185320 0.000249
C -0.775205 1.022296 -0.000045
C 0.287215 -1.269636 0.000180
C 1.690657 0.641303 0.000084
C -2.073059 0.358029 -0.000107
C -2.127306 -1.066827 -0.000242
C 2.501762 -0.595928 0.000071
C -0.923221 -1.885014 -0.000179
C 1.695481 -1.706163 0.000082
C -0.493904 2.418628 -0.000423
C 1.937825 1.995052 -0.000315
C 0.817066 2.872855 -0.000496
C -3.283298 1.095024 -0.000007
C -3.395793 -1.706057 -0.000378
C -4.504950 0.446724 -0.000087
C -4.562254 -0.964741 -0.000289
H -1.030313 -2.969377 -0.000462
H 2.012183 -2.739538 0.000182
H -1.319239 3.129548 -0.000604
H 2.956634 2.388202 -0.000415
H 1.011836 3.946885 -0.000774
H -3.241259 2.184525 0.000183
H -3.440905 -2.795645 -0.000521
H -5.432671 1.019248 0.000024
H -5.532280 -1.460851 -0.000364


%chk=000189238-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189238

0 1
O 4.603869 0.484377 0.000880
O 4.534556 -1.806864 0.000876
N 3.960099 -0.644361 0.000072
C 0.355085 0.193343 -0.000252
C -0.771832 1.035094 -0.000255
C 0.311020 -1.251907 -0.000221
C 1.707796 0.646648 -0.000273
C -2.081371 0.378006 -0.000213
C -2.135161 -1.078030 -0.000167
C 2.515978 -0.588386 -0.000095
C -0.929681 -1.881068 -0.000161
C 1.696709 -1.718400 -0.000222
C -0.499110 2.441779 -0.000291
C 1.960063 2.027288 -0.000322
C 0.831870 2.907014 -0.000302
C -3.307802 1.099785 -0.000248
C -3.411639 -1.725299 -0.000119
C -4.544650 0.436433 -0.000209
C -4.599489 -0.985926 -0.000133
H -1.025100 -2.973251 -0.000095
H 2.051429 -2.748329 -0.000199
H -1.314491 3.172327 -0.000278
H 2.980721 2.417185 -0.000283
H 1.013025 3.987353 -0.000285
H -3.288717 2.194263 -0.000304
H -3.446012 -2.820949 -0.000068
H -5.473894 1.016025 -0.000236
H -5.568174 -1.495651 -0.000099


