%chk=000064081.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064081

0 1
 O   -3.590200      0.5697000     -0.6729000    
 O    1.534900      -1.056900      -1.996400    
 O   -1.189600      0.8368000      -1.887800    
 O   -3.289200       1.675100       1.368600    
 N   0.5539000      0.3760000     -0.4271000    
 N    1.934800       1.537400       1.130600    
 C    2.932900     -0.1354000     -0.3594000    
 C    1.615300     -0.3399000      -1.002800    
 C    3.037900      0.7972000      0.6789000    
 C   -1.631900     -0.7370000     -0.2123000    
 C  -0.7595000      0.2543000     -0.8933000    
 C   0.7919000       1.294400      0.5788000    
 C   -3.007500     -0.5370000     -0.1314000    
 C    4.051600     -0.8569000     -0.7897000    
 C    4.283800      0.9976000       1.283400    
 C   -1.052400      -1.873500      0.3461000    
 C    5.286100     -0.6465000     -0.1767000    
 C    5.402600      0.2794000      0.8581000    
 C   -3.809100      -1.479700      0.5124000    
 C   -1.853900      -2.816300      0.9898000    
 C   -3.232300      -2.619300       1.072900    
 C   -3.678700       1.658800      0.2085000    
 C   -4.331400       2.821600     -0.4783000    
 H  -0.1052000       1.842600      0.9102000    
 H    3.981200      -1.583200      -1.594400    
 H    4.390700       1.716900       2.091900    
 H   1.3600000E-02  -2.069200      0.2968000    
 H    6.157700      -1.204400     -0.5063000    
 H   -4.883700      -1.333600      0.5805000    
 H    6.364900      0.4428000       1.334500    
 H   -1.405600      -3.704800       1.424800    
 H   -3.856500      -3.353600       1.573500    
 H   -3.735100       3.120300      -1.344000    
 H   -4.389500       3.666100      0.2141000    
 H   -5.344600       2.548700     -0.7835000    


%chk=000064081-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000064081

0 1
O -3.774770 0.585597 -0.413177
O 1.477248 -0.711773 -2.247168
O -1.169068 0.589294 -1.817294
O -2.304580 2.040109 0.695934
N 0.508209 0.063358 -0.235304
N 1.839037 0.748856 1.665719
C 2.941923 0.045639 -0.455310
C 1.638392 -0.228312 -1.096051
C 3.003190 0.511448 0.898637
C -1.792021 -0.867519 0.029606
C -0.861647 -0.013678 -0.769042
C 0.678689 0.526784 1.089286
C -3.183009 -0.583107 0.136164
C 4.138714 -0.174183 -1.185751
C 4.269262 0.748520 1.497346
C -1.308040 -2.068907 0.615087
C 5.384372 0.066894 -0.582139
C 5.447137 0.528307 0.762634
C -4.061390 -1.475103 0.777925
C -2.182153 -2.972462 1.251015
C -3.563290 -2.677372 1.325495
C -3.225841 1.871555 -0.123588
C -3.914987 2.911677 -0.962100
H -0.247111 0.740506 1.631260
H 4.058297 -0.531676 -2.217499
H 4.290311 1.105203 2.531333
H -0.241128 -2.301739 0.538712
H 6.308297 -0.100479 -1.145431
H -5.121669 -1.214100 0.842272
H 6.421072 0.714167 1.228417
H -1.791383 -3.899828 1.680823
H -4.250906 -3.374136 1.815999
H -3.507230 2.851329 -1.988362
H -3.718119 3.913995 -0.555614
H -4.997910 2.719634 -1.021734


