%chk=000209163.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209163

0 1
O -4.204431 -2.430722 -0.336789
O 4.731636 -0.882320 0.607206
O -0.879836 4.875849 0.016795
O -4.363485 -1.010612 1.466786
O 3.981298 -2.921505 1.363581
N 0.158208 -0.456593 -1.356955
N -6.230851 -1.615998 0.215666
N 5.335867 -1.553426 2.671651
C -0.522827 -1.533108 -0.569155
C 1.611529 -0.730113 -1.566100
C -2.043393 -1.391846 -0.732247
C 2.463625 -0.740650 -0.286151
C -0.086520 0.896149 -0.883964
C -2.767135 -2.579835 -0.110715
C 3.926622 -1.015108 -0.606702
C -0.116757 1.902169 -1.877700
C -0.327911 1.231182 0.455441
C -0.381752 3.219030 -1.532322
C -0.607213 2.553164 0.818868
C -0.628539 3.532666 -0.177945
C -4.880890 -1.601222 0.542177
C 4.624267 -1.906601 1.533301
C -1.178850 5.315530 1.362711
H -0.248999 -1.528390 0.508800
H -0.187697 -2.512289 -0.980239
H 1.995170 0.040879 -2.272366
H 1.693766 -1.707837 -2.091740
H -2.398370 -0.447921 -0.264020
H -2.305448 -1.296627 -1.806587
H 2.366938 0.226216 0.249626
H 2.092576 -1.510960 0.423196
H -2.575042 -3.535475 -0.632017
H -2.581108 -2.678260 0.973739
H 4.090772 -2.022261 -1.029078
H 4.392115 -0.237892 -1.240830
H 0.058993 1.632657 -2.919875
H -0.310332 0.463336 1.229199
H -0.411245 4.010968 -2.277501
H -0.804259 2.793126 1.858538
H -2.085155 4.825996 1.731035
H -1.345153 6.390562 1.215813
H -0.323026 5.137576 2.019785
H -6.545159 -2.042698 -0.641740
H -6.840129 -0.932064 0.638870
H 5.927487 -0.737067 2.673415
H 5.526744 -2.261157 3.365435


%chk=000209163-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209163

0 1
O -4.018495 -2.876156 -0.202301
O 5.041616 -1.459964 -0.230374
O -0.666111 5.479944 0.099010
O -5.041031 -0.949718 0.708681
O 4.319394 -3.546396 0.612870
N 0.194468 -0.140465 -0.202978
N -6.159040 -2.380541 -0.781813
N 6.352809 -2.563676 1.260438
C -0.651707 -1.107705 0.510067
C 1.323585 -0.678873 -0.973493
C -1.921144 -1.528142 -0.280831
C 2.646257 -0.765806 -0.162131
C -0.046231 1.247353 -0.113754
C -2.769496 -2.523309 0.522349
C 3.778953 -1.362066 -1.008096
C 0.870390 2.200717 -0.662931
C -1.212614 1.764479 0.524800
C 0.628476 3.582098 -0.577551
C -1.449720 3.153577 0.620687
C -0.530401 4.074080 0.067204
C -5.082191 -1.967153 -0.028693
C 5.165008 -2.617218 0.564943
C -1.854310 6.012051 0.761592
H -0.946718 -0.690450 1.493272
H -0.041914 -2.006904 0.726885
H 1.475727 -0.072019 -1.887471
H 1.051885 -1.695380 -1.320951
H -2.525677 -0.631925 -0.505613
H -1.623309 -1.979928 -1.245868
H 2.932288 0.238489 0.199358
H 2.482377 -1.406179 0.724128
H -2.259545 -3.492595 0.653850
H -3.040952 -2.102644 1.508498
H 3.509914 -2.370774 -1.373497
H 4.046044 -0.712062 -1.858713
H 1.790834 1.869766 -1.152758
H -1.966002 1.090602 0.942683
H 1.339089 4.299912 -0.999759
H -2.363432 3.493731 1.118133
H -2.784261 5.673947 0.261766
H -1.768190 7.106066 0.679523
H -1.888263 5.721105 1.830857
H -6.098556 -3.222514 -1.348970
H -7.011980 -1.829593 -0.756428
H 6.975368 -1.766261 1.156125
H 6.592909 -3.335002 1.876153


