%chk=000001237.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001237

0 1
 O    2.618600     -0.1375000       1.500300    
 O   -2.213600       1.523500      0.5649000    
 O   -3.370100     -0.8970000     -0.1634000    
 N    4.244100      0.7955000     -0.6880000    
 C    2.244500     -0.4193000      0.1451000    
 C   0.7604000     -0.5421000      6.4900003E-02
 C    2.789300      0.6906000     -0.7758000    
 C  -4.7300000E-02  0.5574000      0.3550000    
 C   0.1801000      -1.756800     -0.3006000    
 C   -1.435400      0.4425000      0.2795000    
 C   -1.208100      -1.871700     -0.3759000    
 C   -2.015800     -0.7721000     -8.6000003E-02
 C   -2.546600       2.387200     -0.5201000    
 H    2.716700      -1.373300     -0.1220000    
 H    2.376900       1.668500     -0.5043000    
 H    2.506400      0.4877000      -1.815000    
 H   0.3898000       1.506500      0.6544000    
 H   0.7953000      -2.622800     -0.5299000    
 H   -1.647100      -2.823800     -0.6620000    
 H    3.586400     -0.2093000       1.556200    
 H    4.511600       1.089900      0.2501000    
 H    4.565900       1.531500      -1.315500    
 H   -3.589600      -1.805900     -0.4313000    
 H   -3.106700       1.844000      -1.287700    
 H   -1.641400       2.824200     -0.9537000    
 H   -3.174800       3.194900     -0.1348000    


%chk=000001237-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001237

0 1
O 2.621886 0.535440 1.520164
O -2.183934 1.606874 0.805999
O -3.338691 -0.632359 -0.609366
N 4.449358 0.665955 -0.433285
C 2.340918 -0.332125 0.384228
C 0.844601 -0.433784 0.140515
C 3.084454 0.267928 -0.856854
C -0.020964 0.606702 0.546657
C 0.305471 -1.545913 -0.548854
C -1.406667 0.559481 0.281515
C -1.078029 -1.608335 -0.821427
C -1.941743 -0.571498 -0.402351
C -3.192353 2.232037 -0.073508
H 2.748559 -1.352858 0.574082
H 2.546094 1.179871 -1.170840
H 3.058959 -0.452113 -1.701397
H 0.380036 1.455336 1.107390
H 0.955294 -2.372483 -0.860201
H -1.496213 -2.480604 -1.342686
H 3.542339 0.892327 1.307504
H 4.829269 1.486784 -0.911696
H 5.126887 -0.102831 -0.397047
H -3.583320 -1.498442 -1.019972
H -3.967971 1.508030 -0.370271
H -2.707968 2.656061 -0.975086
H -3.626773 3.042819 0.531190


