%chk=000151568.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151568

0 1
 O   -3.451000      -1.585800      0.5314000    
 O  -0.7250000      -1.889400      -1.127000    
 O    3.935100      -1.488300      0.7363000    
 O    4.481100       1.225600      0.5074000    
 N   -1.786300     -8.5699998E-02 -0.1429000    
 N  -8.2000000E-03   2.149200     -0.8269000    
 C   -1.754800       1.151100      0.6241000    
 C   -3.206500       1.408200       1.014000    
 C   -3.151600     -0.5343000     -0.3780000    
 C   -4.006100      0.6912000     -7.7000000E-02
 C  -0.6757000     -0.8022000     -0.5553000    
 C   -1.216500       2.154800     -0.3589000    
 C   0.6556000     -0.2023000     -0.2774000    
 C   0.9194000       1.178300     -0.3965000    
 C    1.677500      -1.088800      9.7499996E-02
 C   -4.815300      -1.973600      0.4483000    
 C    2.222300       1.629400     -0.1308000    
 C    2.959300     -0.6131000      0.3659000    
 C    3.231900      0.7456000      0.2529000    
 C    4.714700      -2.069600     -0.3072000    
 H   -1.093500       1.070100       1.492300    
 H   -3.460200       2.470200       1.083600    
 H   -3.418300      0.9408000       1.983400    
 H   -3.254800     -0.8955000      -1.407400    
 H   -5.037900      0.5181000      0.2305000    
 H   -4.036300       1.335500     -0.9652000    
 H   -1.905300       2.933300     -0.7270000    
 H    1.478600      -2.154200      0.1935000    
 H   -4.890200      -3.000800      0.8182000    
 H   -5.189500      -1.957800     -0.5806000    
 H   -5.435100      -1.354100       1.102000    
 H    2.446400       2.690600     -0.2296000    
 H    4.483800       2.189300      0.3766000    
 H    5.452800      -2.736000      0.1473000    
 H    5.243200      -1.294600     -0.8714000    
 H    4.079700      -2.656300     -0.9786000    


%chk=000151568-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151568

0 1
O -4.142153 -1.060728 0.666082
O -1.292667 -1.718228 -1.220558
O 3.468868 -2.089477 0.271777
O 4.453747 0.631495 0.410594
N -2.130261 0.138202 -0.104989
N 0.006460 2.335829 -0.529842
C -1.993067 1.404320 0.678542
C -3.463820 1.812009 0.955161
C -3.552483 -0.202805 -0.362227
C -4.253370 1.157387 -0.209558
C -1.074977 -0.632113 -0.588608
C -1.238228 2.437709 -0.158171
C 0.331305 -0.178177 -0.291589
C 0.791423 1.180633 -0.256728
C 1.289770 -1.216143 -0.172343
C -3.625296 -2.438302 0.698855
C 2.176645 1.429306 -0.067089
C 2.655124 -0.971160 0.060053
C 3.096392 0.387726 0.138035
C 4.784906 -2.147975 -0.402494
H -1.424120 1.212296 1.610654
H -3.579013 2.908658 1.000035
H -3.802763 1.384477 1.912869
H -3.629585 -0.687357 -1.353580
H -5.321803 1.022485 0.015515
H -4.149518 1.738897 -1.143297
H -1.782143 3.342965 -0.469789
H 0.957993 -2.253326 -0.271610
H -4.308985 -2.992950 1.361318
H -2.597228 -2.471214 1.104958
H -3.614037 -2.885741 -0.312414
H 2.506528 2.475338 -0.083883
H 4.626851 1.604210 0.465993
H 5.185831 -3.138211 -0.139368
H 5.451177 -1.347141 -0.045668
H 4.655799 -2.073993 -1.499132


