%chk=000257811.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257811

0 1
O 2.338141 1.701303 -1.134743
O 4.261559 -2.012241 1.284808
O 4.597112 0.448750 -0.232794
N -1.329405 -2.098590 -0.009986
N -1.293284 -0.702620 2.028336
C -0.542557 -1.667044 1.178106
C -2.639605 -0.028398 0.092393
C -2.195926 -1.179587 -0.644379
C -2.159702 0.234879 1.421030
C 0.821201 -1.098220 0.762311
C -3.586703 0.851152 -0.493458
C -2.667682 -1.420196 -1.929308
C -2.596985 1.353474 2.120386
C 1.973200 -1.758625 1.169524
C 0.890297 0.066503 -0.013010
C -4.063568 0.574090 -1.811603
C -4.027569 1.987360 0.251962
C -3.615446 -0.533117 -2.494743
C -3.545244 2.216669 1.520293
C 2.141085 0.575313 -0.375620
C 3.238981 -1.250330 0.792976
C 3.340689 -0.078817 0.017802
C 1.163520 2.433679 -1.574990
C 5.629187 -1.610676 1.003645
C 4.895923 0.658208 -1.640905
H -0.400435 -2.596369 1.812573
H -0.809411 -2.728098 -0.625305
H -0.746108 -0.362661 2.822809
H -2.342896 -2.283074 -2.499542
H -2.243778 1.568360 3.122734
H 1.943071 -2.663072 1.773894
H -0.026282 0.567132 -0.318517
H -4.790708 1.247602 -2.255799
H -4.754735 2.656963 -0.198061
H -3.985452 -0.746759 -3.498782
H -3.887567 3.081655 2.090708
H 1.618070 3.265956 -2.127110
H 0.597812 2.798434 -0.711854
H 0.548947 1.809704 -2.230517
H 5.802310 -0.585337 1.352546
H 5.826571 -1.694751 -0.068196
H 6.198476 -2.343700 1.586152
H 5.934379 1.002869 -1.601193
H 4.237120 1.435894 -2.047567
H 4.797994 -0.276764 -2.195004


%chk=000257811-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257811

0 1
O 2.381867 1.700397 -1.288435
O 4.334139 -1.901947 1.430941
O 4.657382 0.530365 -0.263558
N -1.379969 -2.049963 -0.101091
N -1.303221 -0.793580 1.935099
C -0.534982 -1.696859 1.053583
C -2.717195 -0.019800 0.104282
C -2.290812 -1.153283 -0.674575
C -2.194590 0.163897 1.433274
C 0.834644 -1.114353 0.655613
C -3.684656 0.905730 -0.430285
C -2.822827 -1.353305 -1.963856
C -2.623331 1.261552 2.205153
C 2.004273 -1.706958 1.157604
C 0.923727 0.027441 -0.182786
C -4.204248 0.675759 -1.748134
C -4.100536 2.013326 0.381755
C -3.779363 -0.435154 -2.485952
C -3.576611 2.174913 1.669644
C 2.189832 0.557142 -0.496284
C 3.288633 -1.186544 0.837862
C 3.395265 -0.046408 -0.005209
C 1.181878 2.414540 -1.741837
C 5.748698 -1.524134 1.272334
C 5.077480 0.574450 -1.680971
H -0.338881 -2.627165 1.623953
H -1.023988 -2.803729 -0.689095
H -0.869894 -0.603124 2.839319
H -2.505072 -2.215205 -2.562916
H -2.228603 1.410467 3.217283
H 1.965455 -2.589281 1.806391
H 0.012125 0.490988 -0.566469
H -4.940316 1.373950 -2.161586
H -4.835136 2.721935 -0.016360
H -4.182601 -0.609855 -3.490226
H -3.898854 3.021276 2.287282
H 1.561388 3.287048 -2.293542
H 0.569754 2.749095 -0.883240
H 0.566356 1.784233 -2.411763
H 5.929073 -0.488161 1.599443
H 6.080697 -1.638172 0.225146
H 6.285777 -2.238383 1.916740
H 6.084237 1.020053 -1.668432
H 4.387487 1.202094 -2.268542
H 5.120119 -0.448385 -2.105558


