%chk=000230790.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230790

0 1
O 2.618207 -1.659315 0.042709
O -2.232061 -1.911767 0.199821
O -3.013679 -0.052802 -0.819827
N 2.033272 0.607397 0.169923
C -0.358235 1.192562 -0.025157
C -0.666821 -0.207025 -0.151337
C 1.012960 1.555548 0.143694
C 0.328792 -1.147438 -0.126606
C 1.683273 -0.675967 0.034123
C -1.335337 2.231795 -0.062321
C 1.376874 2.932131 0.288565
C -2.088327 -0.647054 -0.316977
C -0.963908 3.547187 0.076326
C 0.404120 3.899811 0.256470
C 4.032016 -1.251845 0.208049
C -3.563422 -2.523788 0.153573
C 4.762850 -2.575881 0.169814
C -4.425753 -1.955511 1.259803
H 0.141430 -2.219591 -0.208054
H -2.386154 1.963335 -0.217443
H 2.431665 3.176080 0.420542
H -1.710228 4.339855 0.046657
H 0.664317 4.953032 0.365540
H 4.289318 -0.576508 -0.625591
H 4.120900 -0.721447 1.171369
H -3.991933 -2.358834 -0.851018
H -3.301735 -3.587471 0.303974
H 5.844149 -2.434039 0.285460
H 4.421867 -3.247355 0.970369
H 4.590156 -3.104206 -0.778342
H -5.365795 -2.510830 1.361625
H -3.911410 -1.988024 2.229534
H -4.683666 -0.903634 1.064932


%chk=000230790-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230790

0 1
O 2.515279 -1.685182 0.205037
O -2.320793 -1.888653 -0.080932
O -3.210873 0.257707 -0.098743
N 2.014682 0.624263 0.127182
C -0.378421 1.338309 -0.012075
C -0.767003 -0.064022 -0.001195
C 1.046400 1.620402 0.053984
C 0.224492 -1.045490 0.072062
C 1.599057 -0.646693 0.134320
C -1.287150 2.443604 -0.084228
C 1.502126 2.975092 0.045558
C -2.204716 -0.495394 -0.061992
C -0.810836 3.759493 -0.091116
C 0.589435 4.030625 -0.026122
C 3.955366 -1.306611 0.269549
C -3.711028 -2.438883 -0.109143
C 4.741482 -2.612798 0.320521
C -4.283110 -2.539838 1.307709
H -0.030436 -2.105455 0.081635
H -2.358467 2.239457 -0.131771
H 2.582016 3.143665 0.096868
H -1.521804 4.591112 -0.146937
H 0.945810 5.066683 -0.032658
H 4.199358 -0.696557 -0.619417
H 4.114333 -0.678144 1.164999
H -4.333014 -1.788186 -0.748368
H -3.584587 -3.427646 -0.578032
H 5.824275 -2.395936 0.368771
H 4.465079 -3.205184 1.209700
H 4.548175 -3.223599 -0.577999
H -5.274688 -3.028344 1.273721
H -3.624101 -3.141046 1.957487
H -4.408639 -1.538350 1.751825


