%chk=000122311.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122311

0 1
 O   -3.581800     -0.9308000      0.3455000    
 O   -3.294300       1.806200      6.1700001E-02
 O    4.298300       1.052100     -0.2220000    
 O    4.384600      -1.198400     -2.7000001E-03
 N    1.524900       1.017500     -8.7600000E-02
 C   6.5700002E-02 -0.6536000      0.1472000    
 C   0.1815000      0.7308000      4.1999999E-03
 C    1.385200      -1.186100      0.1391000    
 C    2.260200     -0.1345000     -7.1999999E-03
 C   -1.220000      -1.218200      0.2632000    
 C  -0.9286000       1.582200     -2.8000001E-02
 C   -2.339700     -0.3787000      0.2328000    
 C   -2.193700      0.9997000      8.9400001E-02
 C    3.687100     -0.1705000     -7.1699999E-02
 C   -4.229400      -1.317600     -0.8639000    
 H    1.658600      -2.229100      0.2302000    
 H    1.909200       1.945900     -0.1983000    
 H   -1.340300      -2.292300      0.3762000    
 H  -0.8101000       2.655200     -0.1401000    
 H   -4.084900       1.256300      0.1984000    
 H   -5.223000      -1.699500     -0.6137000    
 H   -3.664700      -2.112400      -1.361700    
 H   -4.343200     -0.4615000      -1.536500    
 H    5.274700      0.9647000     -0.2597000    


%chk=000122311-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122311

0 1
O -3.777814 -0.389748 -0.269716
O -3.243082 2.153987 0.165916
O 4.287226 0.988293 0.159706
O 4.375639 -1.321092 -0.222093
N 1.584261 1.065405 0.103976
C -0.014058 -0.540337 -0.201707
C 0.210456 0.868392 0.037630
C 1.273351 -1.170222 -0.276100
C 2.238618 -0.166836 -0.084033
C -1.350658 -1.028975 -0.315558
C -0.850010 1.796630 0.166089
C -2.395017 -0.110560 -0.189149
C -2.150358 1.293392 0.050441
C 3.687978 -0.282030 -0.067167
C -4.173743 -1.775940 -0.516693
H 1.497248 -2.221491 -0.445599
H 2.079813 1.941376 0.260988
H -1.537717 -2.091024 -0.497113
H -0.697238 2.863529 0.346862
H -4.073206 1.616423 0.054739
H -5.273046 -1.769121 -0.544215
H -3.821654 -2.437224 0.298064
H -3.774897 -2.131930 -1.485998
H 5.274207 0.876505 0.165528


