%chk=000256676.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256676

0 1
O -2.143535 0.870905 1.138544
O -0.026089 1.370935 1.733021
N 6.143500 0.052014 0.118174
N -1.852288 -0.626936 -0.562986
C 4.756604 -0.045266 -0.111067
C 1.966982 -0.471816 -0.473166
C 4.259221 -0.623684 -1.311373
C 3.826173 0.311747 0.897289
C 2.901356 -0.837367 -1.473305
C 2.466846 0.099052 0.714502
C 0.565423 -0.725451 -0.734182
C -0.535808 -0.234362 -0.122027
C -2.732093 0.015371 0.167666
C -4.191222 -0.003308 0.150157
C 7.051431 0.039677 -1.058341
C 6.612758 0.965675 1.192444
C -0.715951 0.734804 0.992612
C -4.866625 -0.824641 -0.769347
C -4.915625 0.797831 1.050320
C -6.263095 -0.840108 -0.783507
C -6.310900 0.774252 1.027072
C -6.984289 -0.043123 0.111932
H 4.944303 -0.914470 -2.104356
H 4.168065 0.751300 1.832440
H 2.542608 -1.289778 -2.400718
H 1.779715 0.382520 1.520030
H 0.374232 -1.420487 -1.576470
H 6.966946 0.943708 -1.682991
H 6.839054 -0.843266 -1.687932
H 8.096653 -0.054330 -0.718966
H 6.447375 2.030672 0.961791
H 7.689631 0.808366 1.369969
H 6.094293 0.728509 2.139581
H -4.296751 -1.444662 -1.465758
H -4.378530 1.432286 1.760801
H -6.790050 -1.475185 -1.494356
H -6.875181 1.393621 1.723069
H -8.073736 -0.058608 0.097135


%chk=000256676-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256676

0 1
O -2.251620 0.804049 1.409210
O -0.046850 1.283462 2.075125
N 6.198024 0.210656 -0.035337
N -1.883129 -0.380510 -0.543747
C 4.822129 0.073596 -0.177086
C 1.955173 -0.201998 -0.462926
C 4.254060 -0.629227 -1.293975
C 3.914200 0.630370 0.787621
C 2.869174 -0.755975 -1.420933
C 2.530156 0.498445 0.650425
C 0.545643 -0.396960 -0.702497
C -0.607908 -0.017397 -0.018805
C -2.793747 0.100474 0.288336
C -4.246117 -0.002978 0.196781
C 7.107831 -0.366251 -1.037736
C 6.755471 0.939997 1.115697
C -0.800387 0.746431 1.238461
C -4.829389 -0.697864 -0.899678
C -5.082428 0.580648 1.187831
C -6.229607 -0.804999 -0.999334
C -6.483920 0.468342 1.079385
C -7.062326 -0.222962 -0.011370
H 4.900007 -1.071622 -2.057064
H 4.300645 1.172380 1.655085
H 2.463732 -1.297832 -2.284860
H 1.871095 0.937330 1.405364
H 0.307479 -0.963059 -1.615206
H 6.934275 0.066060 -2.043134
H 6.990728 -1.465604 -1.110037
H 8.149216 -0.153954 -0.751654
H 6.408801 1.991803 1.138596
H 7.854054 0.945374 1.047731
H 6.473831 0.463566 2.075182
H -4.169371 -1.140582 -1.652579
H -4.624541 1.112601 2.027368
H -6.675547 -1.340490 -1.844680
H -7.125652 0.919111 1.844290
H -8.151781 -0.308032 -0.092145


