%chk=000023216.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023216

0 1
 O    4.925200       2.521200      -1.341400    
 O   -2.274900      -1.421100       2.016600    
 O    6.460800       2.626400      0.5128000    
 O   -6.543300      0.4996000      -1.590400    
 O   -6.877200       2.308600     -3.3599999E-02
 N    2.218200      -1.853400     -0.5911000    
 N  -0.6128000      -2.114100     -6.5200001E-02
 C    1.585000      -1.159400      0.5370000    
 C    1.496400      -3.093800     -0.9006000    
 C   0.1085000     -0.8730000      0.2423000    
 C   1.9700000E-02  -2.807700      -1.194000    
 C    3.625400      -2.128500     -0.3076000    
 C   -2.020400      -1.840200     -0.3470000    
 C    4.404500     -0.8648000     -5.7100002E-02
 C   -2.652500      -1.189700      0.8699000    
 C    4.224300      0.2243000     -0.9025000    
 C    5.293700     -0.8146000       1.022400    
 C   -3.778300     -0.2313000      0.6588000    
 C    4.960400       1.359700     -0.6328000    
 C    5.837300       1.420000      0.4260000    
 C    6.026800      0.3477000       1.273500    
 C   -4.598300     -0.4157000     -0.4334000    
 C   -3.943800      0.7993000       1.572400    
 C   -5.623600      0.4948000     -0.5873000    
 C   -5.814200       1.527800      0.3015000    
 C    5.877900       3.319300     -0.6095000    
 C   -4.990100       1.707500       1.393400    
 C   -7.334700       1.651100      -1.232900    
 H    2.055200     -0.1920000      0.7429000    
 H    1.664100      -1.757100       1.455900    
 H    1.574800      -3.810600     -7.1900003E-02
 H    1.937600      -3.568500      -1.785500    
 H  -0.2912000     -0.3631000       1.124300    
 H   3.5599999E-02 -0.1646000     -0.5949000    
 H  -6.4999998E-02  -2.215700      -2.115500    
 H  -0.4877000      -3.763500      -1.372700    
 H    4.089700      -2.631500      -1.166000    
 H    3.717300      -2.810100      0.5486000    
 H   -2.112200      -1.187100      -1.222700    
 H   -2.562300      -2.773900     -0.5367000    
 H    3.549400      0.1976000      -1.750800    
 H    5.426000      -1.673500       1.675000    
 H    6.719100      0.3990000       2.106100    
 H   -4.483100      -1.228400      -1.139800    
 H   -3.277600      0.9236000       2.421300    
 H    5.372400       4.219800     -0.2421000    
 H    6.681100       3.620300      -1.291900    
 H   -5.142800       2.523700       2.090400    
 H   -8.372400       1.331200      -1.083700    
 H   -7.303300       2.369100      -2.060500    


%chk=000023216-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000023216

0 1
O 5.782420 2.237812 -1.493703
O -2.237723 -0.404805 2.043782
O 7.578072 2.034585 0.093181
O -6.911320 0.440584 -1.888644
O -8.171166 1.091063 0.051648
N 2.293633 -1.625653 -0.355585
N -0.576477 -1.348250 -0.059698
C 1.705836 -0.892390 0.795265
C 1.368521 -2.687873 -0.815155
C 0.347784 -0.286369 0.415577
C 0.012169 -2.080459 -1.207896
C 3.654602 -2.139108 -0.076823
C -1.931229 -0.871574 -0.347990
C 4.699313 -1.032272 0.037224
C -2.742473 -0.430072 0.884411
C 4.633030 0.088188 -0.843532
C 5.754577 -1.138540 0.974997
C -4.170942 -0.019364 0.659773
C 5.640767 1.044859 -0.735624
C 6.695318 0.927732 0.195434
C 6.781354 -0.156811 1.069591
C -4.772112 -0.021732 -0.640929
C -4.933157 0.369429 1.796282
C -6.106939 0.363874 -0.723406
C -6.852848 0.747211 0.414139
C 7.011490 2.896408 -0.979111
C -6.289693 0.759899 1.694909
C -8.246334 0.901913 -1.426330
H 2.398463 -0.085092 1.092504
H 1.563962 -1.569572 1.673899
H 1.195024 -3.457832 -0.021275
H 1.812386 -3.192782 -1.694337
H -0.097703 0.191594 1.302324
H 0.505200 0.490225 -0.376662
H 0.164808 -1.410022 -2.092812
H -0.677159 -2.893564 -1.505927
H 3.924164 -2.808819 -0.919370
H 3.686979 -2.767147 0.850205
H -1.943815 -0.015028 -1.078563
H -2.493440 -1.693296 -0.836055
H 3.804175 0.176588 -1.550538
H 5.784262 -1.999773 1.652298
H 7.594032 -0.241112 1.795403
H -4.222877 -0.308215 -1.540445
H -4.430832 0.354268 2.768393
H 6.741058 3.875769 -0.546678
H 7.745884 2.978359 -1.799263
H -6.872539 1.056800 2.570024
H -8.995683 0.123001 -1.647404
H -8.478126 1.872063 -1.897509


