%chk=000117506.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117506

0 1
 O  -0.5483000       1.458200     -0.3296000    
 O    2.143800     -0.6532000      0.4347000    
 O  -0.8360000       3.222600       1.120800    
 O    3.681300      -1.146100      -1.206300    
 N  -0.7901000       3.545200      -1.155300    
 N    4.340100     -0.3405000      0.8441000    
 C  -0.2642000     -0.8867000      0.2820000    
 C   -1.442900      -1.316900     -0.6203000    
 C   -2.833100      -1.348100      4.7499999E-02
 C  -0.4730000      0.5602000      0.7688000    
 C    1.086500      -1.050300     -0.4303000    
 C   -2.802000      -2.289400       1.255700    
 C   -3.937300      -1.783800     -0.9158000    
 C  -0.7337000       2.778400     -1.7800000E-02
 C    3.408800     -0.7495000     -7.8199998E-02
 H  -0.2226000      -1.523600       1.173200    
 H   -1.488400     -0.6629000      -1.500900    
 H   -1.225800      -2.320700      -1.010800    
 H   -3.095100     -0.3430000      0.3960000    
 H   -1.386600      0.6354000       1.368700    
 H   0.3608000      0.8571000       1.416700    
 H    1.112300     -0.4404000      -1.341500    
 H    1.226900      -2.101600     -0.7097000    
 H   -2.428500      -3.281900      0.9818000    
 H   -2.177900      -1.893300       2.062000    
 H   -3.807900      -2.414700       1.672100    
 H   -4.915700      -1.767400     -0.4241000    
 H   -3.984100      -1.110100      -1.777800    
 H   -3.760600      -2.798400      -1.288600    
 H  -0.7000000       3.130500      -2.076700    
 H  -0.9237000       4.549700      -1.109400    
 H    4.064700     -2.0000000E-02   1.766300    
 H    5.332000     -0.3460000      0.6317000    


%chk=000117506-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000117506

0 1
O -0.560816 1.445642 -0.341631
O 2.182410 -0.762448 0.469313
O -0.952135 3.242792 1.135205
O 3.706299 -0.852337 -1.330059
N -0.864664 3.530781 -1.195077
N 4.395172 -0.433547 0.876910
C -0.242438 -0.886115 0.293356
C -1.421178 -1.365358 -0.597703
C -2.825760 -1.345941 0.063944
C -0.426852 0.540030 0.832066
C 1.073226 -1.022673 -0.487567
C -2.892582 -2.230635 1.331993
C -3.890897 -1.795207 -0.965071
C -0.806949 2.795534 -0.029511
C 3.465223 -0.694419 -0.107564
H -0.169722 -1.543832 1.183212
H -1.452305 -0.737377 -1.509834
H -1.209118 -2.403656 -0.930478
H -3.061945 -0.301318 0.354873
H -1.330420 0.635079 1.459339
H 0.448174 0.857528 1.425016
H 1.135844 -0.295486 -1.315892
H 1.193898 -2.041619 -0.898961
H -2.617458 -3.276329 1.091939
H -2.212314 -1.875556 2.127839
H -3.915833 -2.238754 1.751007
H -4.907834 -1.746493 -0.533487
H -3.872875 -1.155959 -1.867597
H -3.710090 -2.839708 -1.285859
H -0.716539 3.084642 -2.096746
H -1.038264 4.529497 -1.131141
H 4.105459 -0.311984 1.844009
H 5.372982 -0.355972 0.613159


