%chk=000106188.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106188

0 1
 O   1.1000000E-03  -2.865800     -0.9437000    
 O   -7.769000       2.265500      -1.209300    
 O    7.793900       2.226600      -1.241700    
 N   -7.559300      0.5571000      0.4020000    
 N    7.554300      0.5673000      0.4160000    
 C  -2.9000000E-03  0.9229000      0.8074000    
 C   -1.250800      5.4099999E-02  0.9869000    
 C    1.245300      5.5100001E-02  0.9899000    
 C   -1.271600      -1.101100      2.8800000E-02
 C    1.269400      -1.099500      3.1099999E-02
 C  -4.6999999E-03   2.082200       1.803200    
 C  -3.0000001E-04  -1.791200     -0.3495000    
 C   -2.408100      -1.539300     -0.5334000    
 C    2.407500      -1.535600     -0.5293000    
 C   -3.751100     -0.9926000     -0.2892000    
 C    3.749200     -0.9869000     -0.2827000    
 C   -4.533700      -1.532200      0.7209000    
 C    4.229700      3.0200001E-02  -1.094200    
 C   -4.214100      5.3500000E-02  -1.073500    
 C    4.513300      -1.496200      0.7569000    
 C   -5.808000      -1.014200      0.9518000    
 C    5.503000      0.5499000     -0.8608000    
 C   -5.488400      0.5717000     -0.8427000    
 C    5.786600     -0.9765000      0.9903000    
 C   -6.285400      3.7700001E-02  0.1700000    
 C    6.281300      4.6500001E-02  0.1815000    
 C   -8.203800       1.602200     -0.2734000    
 C    8.213900       1.587400     -0.2826000    
 C   -9.581200       1.862200      0.2832000    
 C    9.584000       1.859000      0.2861000    
 H  -1.9000000E-03   1.347900     -0.2062000    
 H   -2.130300      0.6977000      0.8765000    
 H   -1.282000     -0.3450000       2.009800    
 H    1.274700     -0.3441000       2.012600    
 H    2.124500      0.6995000      0.8808000    
 H  -0.8895000       2.712100       1.663800    
 H  -5.7000001E-03   1.720600       2.837100    
 H   0.8800000       2.712900       1.666000    
 H   -2.403800      -2.370100      -1.235600    
 H    2.405200      -2.364300      -1.233900    
 H   -4.173200      -2.352000       1.336800    
 H    3.631900      0.4302000      -1.909300    
 H   -3.601900      0.4774000      -1.865400    
 H    4.139300      -2.293300       1.394100    
 H   -6.418000      -1.439700       1.744700    
 H    5.817200       1.339800      -1.528400    
 H   -5.788100       1.385700      -1.487700    
 H    6.382100      -1.378100       1.806300    
 H   -8.077300      0.1148000       1.158400    
 H    8.058700      0.1473000       1.194000    
 H   -10.20470      0.9728000      0.1561000    
 H   -10.04340       2.699400     -0.2471000    
 H   -9.511400       2.111100       1.345900    
 H    9.493500       2.194400       1.323100    
 H    10.08000       2.639100     -0.2982000    
 H    10.18910      0.9488000      0.2474000    


%chk=000106188-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000106188

0 1
O 0.000674 -0.645825 -2.121833
O -9.117660 -0.157328 -1.618712
O 9.117516 -0.146288 -1.611942
N -8.035474 -0.063786 0.464966
N 8.033733 -0.053429 0.470909
C -0.002366 1.675592 1.326245
C -1.260643 0.798670 1.137258
C 1.257134 0.800186 1.138351
C -1.297417 0.118771 -0.222837
C 1.295969 0.120574 -0.221826
C -0.003408 2.369164 2.703488
C -0.000239 -0.154872 -0.938999
C -2.445044 -0.249912 -0.893071
C 2.444582 -0.246233 -0.891386
C -3.852895 -0.185692 -0.493716
C 3.852079 -0.180184 -0.491020
C -4.325679 -0.106469 0.853125
C 4.842851 -0.245364 -1.518463
C -4.842820 -0.252846 -1.521880
C 4.323716 -0.101098 0.856248
C -5.699614 -0.073478 1.138096
C 6.221064 -0.195109 -1.250763
C -6.221288 -0.204270 -1.255264
C 5.697378 -0.066562 1.142293
C -6.664266 -0.109321 0.092991
C 6.662863 -0.100513 0.097881
C -9.169090 -0.087331 -0.356631
C 9.167974 -0.076350 -0.349802
C -10.497859 -0.021345 0.393887
C 10.496161 -0.010179 0.401736
H -0.002490 2.455370 0.536580
H -2.167136 1.420416 1.266230
H -1.278229 0.041943 1.953577
H 1.274828 0.043360 1.954576
H 2.162763 1.422986 1.268280
H -0.897133 3.008122 2.829238
H -0.003447 1.621389 3.520946
H 0.889540 3.009029 2.830150
H -2.261483 -0.642760 -1.905072
H 2.262267 -0.639035 -1.903634
H -3.619948 -0.116246 1.686589
H 4.511243 -0.328795 -2.560402
H -4.510296 -0.336483 -2.563509
H 3.617331 -0.112311 1.689134
H -6.032647 -0.028588 2.183672
H 6.957891 -0.233913 -2.054418
H -6.957441 -0.244496 -2.059460
H 6.029597 -0.021941 2.188141
H -8.211896 -0.005523 1.470444
H 8.209318 0.005302 1.476503
H -11.095606 -0.914006 0.141170
H -11.063493 0.858727 0.042484
H -10.394447 0.037841 1.491505
H 11.065587 0.864902 0.044232
H 11.090730 -0.907118 0.156535
H 10.391764 0.057557 1.498776


