%chk=000137324.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137324

0 1
 O  -0.3232000      -1.438100      -1.112300    
 O    3.568000      -1.795900       1.009400    
 O   0.1861000      0.7742000      -1.550100    
 O    5.385000      0.3251000      0.6935000    
 O   -6.081400       2.051000       1.186100    
 O   -6.722600      7.6200001E-02  0.4729000    
 N    1.097600      -1.656000     -0.8703000    
 N    3.081400      0.3931000      0.3505000    
 N    5.430200       3.082000      0.7513000    
 N   -5.836800      0.9504000      0.6351000    
 C    1.305700      -1.210600      0.5148000    
 C   0.8575000      -2.350200       1.425400    
 C   0.6531000      -3.548500      0.5058000    
 C    1.241100      -3.118800     -0.8279000    
 C    2.770500     -0.9287000      0.6632000    
 C  -0.5734000     -0.1047000      -1.171000    
 C    4.366900      0.9404000      0.3840000    
 C    4.364700       2.416700      6.0000001E-03
 C   -1.955000      0.1725000     -0.6987000    
 C    4.589100       2.578000      -1.492300    
 C   -2.221100       1.383500     -9.4800003E-02
 C   -2.925900     -0.7906000     -0.8780000    
 C   -3.517400       1.643400      0.3500000    
 C   -4.222200     -0.5307000     -0.4333000    
 C   -4.518000      0.6863000      0.1808000    
 H   0.7722000     -0.2987000      0.8078000    
 H    1.569100      -2.585100       2.223800    
 H  -9.7900003E-02  -2.105500       1.905200    
 H  -0.4178000      -3.761000      0.4043000    
 H    1.138500      -4.449000      0.8945000    
 H    2.304700      -3.380900     -0.8754000    
 H   0.7521000      -3.612600      -1.674900    
 H    2.319400       1.001700      6.1500002E-02
 H    3.410300       2.875600      0.2861000    
 H    4.612200       3.635600      -1.776200    
 H    3.783900       2.095200      -2.057200    
 H    5.531100       2.116900      -1.811300    
 H   -1.449200       2.134100      4.6200000E-02
 H   -2.725600      -1.740400      -1.364800    
 H    5.297300       2.936600       1.751200    
 H    6.333200       2.672700      0.5143000    
 H   -3.710900       2.601800      0.8251000    
 H   -4.976900      -1.298400     -0.5842000    


%chk=000137324-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137324

0 1
O -0.263784 -1.307561 -0.200796
O 4.235148 -1.820201 1.522729
O 0.465937 0.907109 0.032097
O 5.458115 0.802319 0.952624
O -6.299093 2.856190 -0.258843
O -6.910188 0.672461 -0.512797
N 1.243819 -1.655850 -0.339119
N 3.213799 0.124820 0.635653
N 4.804500 3.495323 0.243216
N -6.026721 1.599766 -0.359478
C 1.806617 -1.840836 1.067940
C 1.802660 -3.360991 1.395282
C 1.002503 -4.019805 0.237229
C 1.226598 -3.037071 -0.933872
C 3.233838 -1.197083 1.098030
C -0.462310 0.069071 -0.108251
C 4.291810 1.043389 0.558816
C 3.886973 2.401227 -0.097231
C -1.912725 0.423510 -0.172110
C 3.831065 2.216288 -1.635833
C -2.261661 1.795548 -0.064818
C -2.922079 -0.561158 -0.340221
C -3.610386 2.189404 -0.126605
C -4.274767 -0.179289 -0.402177
C -4.595254 1.191603 -0.293962
H 1.177311 -1.260978 1.765378
H 2.848131 -3.715637 1.422421
H 1.354511 -3.564085 2.381085
H -0.073879 -4.078467 0.479370
H 1.360851 -5.036491 0.004723
H 2.234319 -3.167445 -1.373496
H 0.484397 -3.076886 -1.744750
H 2.293664 0.449653 0.281350
H 2.872334 2.672737 0.255899
H 3.542338 3.174579 -2.098119
H 3.102853 1.439920 -1.930097
H 4.824842 1.926351 -2.024871
H -1.464516 2.533922 0.062983
H -2.641619 -1.614128 -0.422654
H 4.783839 3.739225 1.241094
H 5.769490 3.281579 -0.041334
H -3.911205 3.237100 -0.048801
H -5.076470 -0.910535 -0.531583


