%chk=000057965.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057965

0 1
 O    3.325200      0.6843000      0.6064000    
 O   -2.480900      -2.024900     -0.4092000    
 N   -1.611300      1.2000001E-03  8.9699998E-02
 N    3.408400     -0.6395000      -1.271600    
 N   -2.785400     -0.8450000     -0.2013000    
 N   -1.960900       2.375500     -0.6511000    
 C   0.6221000      0.1177000       1.129500    
 C    1.324400     -0.5056000     -7.7200003E-02
 C  -0.8167000     -0.3626000       1.282800    
 C    2.775300     -7.7500001E-02 -0.1835000    
 C   -1.800100       1.276300     -0.3145000    
 H   0.6554000       1.211500       1.050400    
 H    1.173300     -0.1380000       2.043300    
 H   -1.269000      9.2699997E-02   2.172100    
 H  -0.8186000      -1.448100       1.435600    
 H   0.8239000     -0.2194000      -1.009200    
 H    1.296500      -1.599300     -1.7000000E-03
 H    4.383800     -0.4406000      -1.467900    
 H    2.932600      -1.267100      -1.912000    


%chk=000057965-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000057965

0 1
O 3.465070 -0.185953 0.945692
O -1.877565 -2.157862 -0.277963
N -1.738708 0.075381 0.172349
N 3.384616 -0.557250 -1.341855
N -2.260257 -1.022314 -0.665929
N -2.410954 2.423422 -0.568230
C 0.626391 0.217854 1.060964
C 1.263887 -0.612445 -0.072739
C -0.841061 -0.158440 1.343653
C 2.790000 -0.422710 -0.099076
C -2.095197 1.320779 -0.218297
H 0.705318 1.297411 0.831713
H 1.211935 0.052489 1.984149
H -1.241507 0.421201 2.193567
H -0.935252 -1.236769 1.571370
H 0.821361 -0.357246 -1.054367
H 1.065695 -1.689512 0.099481
H 4.400090 -0.483930 -1.406729
H 2.844136 -0.732508 -2.187155


