%chk=000235489.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235489

0 1
O -1.549431 -0.996683 1.064975
O -2.060263 -2.849772 -1.399200
O -3.273968 0.433199 -1.478044
O -4.255614 1.389930 0.764494
N 0.076099 -0.144016 -0.423052
N 0.757006 1.992685 -0.972244
N 2.232994 -0.980927 0.529827
N 4.011297 0.761704 0.437224
N 4.445713 -1.428955 1.225338
C -1.868141 -1.442178 -1.276761
C -0.820786 -1.276541 -0.140335
C -3.158747 -0.776603 -0.728447
C -2.898349 -0.539862 0.782356
C -2.969269 0.924882 1.234117
C 1.422875 -0.045417 -0.038763
C -0.269194 1.149469 -0.974397
C 1.839977 1.294325 -0.397294
C 3.175097 1.651288 -0.125893
C 3.525116 -0.524907 0.729609
H -1.559224 -0.999970 -2.248609
H -0.231813 -2.201868 0.094925
H -4.062554 -1.397022 -0.901435
H -3.538628 -1.191796 1.417849
H -2.171572 1.541141 0.780472
H -2.922719 1.008172 2.334124
H -2.372227 -3.074298 -2.303475
H -3.988982 1.015770 -1.082757
H -1.275462 1.335863 -1.353355
H -4.422939 2.297361 1.092369
H 3.568192 2.650236 -0.357278
H 4.120958 -2.309226 1.596271
H 5.346960 -1.093582 1.531588


%chk=000235489-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235489

0 1
O -1.513722 -0.850308 1.104424
O -1.958401 -2.873648 -1.201553
O -3.150218 0.599781 -1.462560
O -4.564181 1.226504 0.719356
N 0.158933 -0.008850 -0.453340
N 0.938234 2.060931 -1.106265
N 2.242445 -0.934893 0.504981
N 4.134647 0.652069 0.349625
N 4.383649 -1.470997 1.309332
C -1.794516 -1.416192 -1.226007
C -0.747027 -1.113601 -0.130169
C -3.088341 -0.690116 -0.772673
C -2.933026 -0.563150 0.775604
C -3.258176 0.840664 1.314940
C 1.511363 0.030256 -0.094010
C -0.125103 1.247964 -1.053276
C 1.984300 1.317241 -0.508436
C 3.347411 1.582555 -0.255131
C 3.552367 -0.558663 0.701304
H -1.483204 -1.052769 -2.223308
H -0.115564 -1.994931 0.068167
H -3.983861 -1.293224 -1.021122
H -3.545853 -1.327558 1.285270
H -2.467824 1.550003 1.005201
H -3.322856 0.817453 2.417615
H -2.589333 -3.142529 -1.916025
H -3.882307 1.117563 -1.013040
H -1.123858 1.468587 -1.430005
H -4.940487 2.009707 1.189335
H 3.820039 2.531396 -0.529747
H 4.012411 -2.371618 1.597655
H 5.354459 -1.217226 1.468058


