%chk=000050350.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050350

0 1
 O   -2.822500      -2.964000      0.2526000    
 O    3.257600      0.1185000      0.2620000    
 N    1.100100     -0.7200000     -0.1832000    
 C   -1.092400      0.3161000     -0.3154000    
 C   -1.738600     -0.9950000     -0.6258000    
 C   0.2837000      0.4114000     -0.1072000    
 C   -1.890400       1.457400     -0.2352000    
 C   -2.188100      -1.748300      0.6283000    
 C   0.8614000       1.647900      0.1812000    
 C   -1.312500       2.693800      5.3300001E-02
 C   6.3400000E-02   2.789000      0.2615000    
 C    2.486300     -0.7978000     -2.7999999E-03
 C    2.991800      -2.209000     -0.1693000    
 H   -1.115900      -1.633100      -1.263400    
 H   -2.621500     -0.8183000      -1.257200    
 H   -2.964300       1.398800     -0.3924000    
 H   -2.893400      -1.157800       1.222900    
 H   -1.333800      -1.995800       1.266500    
 H    1.915600       1.808000      0.3551000    
 H   0.6379000      -1.603100     -0.3744000    
 H   -1.933900       3.582200      0.1165000    
 H   0.5119000       3.752400      0.4863000    
 H   -3.594300      -2.735200     -0.2928000    
 H    2.545000      -2.853500      0.5928000    
 H    4.079600      -2.228400     -5.8600001E-02
 H    2.730700      -2.582700      -1.163500    


%chk=000050350-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000050350

0 1
O -2.473005 -3.147974 0.297640
O 3.212966 0.043963 0.406126
N 1.059858 -0.699113 -0.192852
C -1.126033 0.398560 -0.371630
C -1.799253 -0.934506 -0.671688
C 0.279652 0.492554 -0.108214
C -1.904738 1.577133 -0.301867
C -2.052372 -1.774419 0.609610
C 0.861327 1.746781 0.219135
C -1.332844 2.826789 0.022949
C 0.053218 2.900966 0.283998
C 2.427359 -0.880276 0.047478
C 2.893700 -2.322825 -0.160460
H -1.212271 -1.558061 -1.377477
H -2.767286 -0.750386 -1.175780
H -2.979853 1.508805 -0.510102
H -2.790897 -1.258424 1.257239
H -1.123271 -1.898285 1.190710
H 1.932867 1.795647 0.419164
H 0.555409 -1.538755 -0.485038
H -1.957737 3.724947 0.068558
H 0.515217 3.861212 0.538707
H -3.362220 -3.128305 -0.137742
H 2.382608 -3.014105 0.535334
H 3.975948 -2.370397 0.026185
H 2.695055 -2.668026 -1.192181


