%chk=000030258.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030258

0 1
 O   -4.736000      -1.839700      0.7101000    
 O  -0.6616000       1.313800     -0.9559000    
 O    3.420200       1.364100       1.500900    
 O    5.342800     -0.1977000      0.4712000    
 N   -3.222200      0.4105000     -0.1537000    
 C   -2.906600     -0.2941000       1.096600    
 C   -4.655900      0.2884000     -0.4524000    
 C   -2.826900       1.815000     -7.1699999E-02
 C   -3.338600      -1.754000      0.9913000    
 C   -5.047400      -1.185000     -0.5203000    
 C   -1.325800       1.939100      0.1344000    
 C   0.5740000      0.7784000     -0.7018000    
 C    1.380500       1.344400      0.2792000    
 C    1.007800     -0.3260000      -1.426300    
 C    3.079600     -0.3098000     -0.1836000    
 C    2.637600      0.7985000      0.5390000    
 C    2.264700     -0.8719000      -1.166400    
 C    4.390000     -0.8927000      6.8400003E-02
 C    4.623700      -2.381300     -0.1590000    
 H   -3.418200      0.1798000       1.944300    
 H   -1.833700     -0.3104000       1.305600    
 H   -4.886600      0.7613000      -1.413800    
 H   -5.249800      0.7879000      0.3241000    
 H   -3.358500       2.340600      0.7313000    
 H   -3.083500       2.308200      -1.018000    
 H   -2.775600      -2.288200      0.2161000    
 H   -3.159500      -2.265900       1.942300    
 H   -6.126200      -1.276800     -0.6823000    
 H   -4.542900      -1.700000      -1.346900    
 H   -1.031800       1.549600       1.115100    
 H   -1.065600       3.005200      0.1198000    
 H    1.082500       2.226900      0.8380000    
 H   0.3766000     -0.7649000      -2.193800    
 H    2.586900      -1.725800      -1.755800    
 H    4.935000      -2.550000      -1.192700    
 H    3.721200      -2.955700      6.6699997E-02
 H    5.409800      -2.726200      0.5196000    
 H    4.225500      0.8411000       1.639200    


%chk=000030258-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030258

0 1
O -5.784140 -1.307275 0.815039
O -0.560993 0.634175 -0.699524
O 3.564825 0.775022 1.877647
O 5.561693 -0.458042 0.979370
N -3.507074 0.353124 0.126799
C -4.007911 0.275376 1.521538
C -4.610357 0.125798 -0.839969
C -2.721098 1.574609 -0.142651
C -4.680505 -1.086163 1.763550
C -5.269289 -1.235881 -0.563371
C -1.263247 1.455590 0.308451
C 0.772911 0.314262 -0.473547
C 1.513708 0.740298 0.648384
C 1.372925 -0.500836 -1.484418
C 3.498057 -0.475207 -0.232311
C 2.868398 0.349598 0.775120
C 2.708157 -0.879514 -1.353942
C 4.899088 -0.857223 -0.063890
C 5.611090 -1.720034 -1.089000
H -4.744620 1.092084 1.735668
H -3.162906 0.389955 2.227117
H -4.194164 0.128687 -1.864817
H -5.391493 0.925516 -0.777928
H -3.167361 2.477077 0.347640
H -2.721577 1.767215 -1.231101
H -3.926242 -1.895292 1.658061
H -5.138306 -1.131765 2.765487
H -6.145030 -1.394150 -1.214145
H -4.526747 -2.045913 -0.727825
H -1.186100 0.968999 1.300271
H -0.782875 2.454366 0.356784
H 1.092209 1.367995 1.436519
H 0.762709 -0.810540 -2.336689
H 3.161786 -1.504009 -2.130609
H 5.623806 -1.232279 -2.080984
H 5.109407 -2.698081 -1.205991
H 6.646875 -1.884726 -0.756478
H 4.529894 0.383885 1.784544


