%chk=000033065.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000033065

0 1
 O   0.8278000       2.765700      0.2685000    
 N   -2.541300      0.1881000     -8.6700000E-02
 N   -1.345400      0.7025000     -0.4455000    
 C   -5.120500      -1.198500     -5.7700001E-02
 C   -3.906000      -1.739400      0.6857000    
 C   -5.019800      0.3150000     -0.1980000    
 C   -2.602000      -1.272700      3.9400000E-02
 C   -3.688200      0.7287000     -0.8231000    
 C  -0.6054000      0.9751000      0.5711000    
 C   0.7488000       1.547300      0.3203000    
 C    1.914200      0.6516000      0.1576000    
 C    1.728500     -0.7160000      0.2415000    
 C    3.160200       1.204200     -7.4600004E-02
 C    4.093300      -1.023200     -0.1472000    
 C    2.827800      -1.560900      8.7899998E-02
 C    4.259500      0.3593000     -0.2284000    
 C    5.268700      -1.926800     -0.3107000    
 H   -5.178200      -1.657500      -1.052100    
 H   -6.038700      -1.466700      0.4761000    
 H   -3.937500      -1.403700       1.730000    
 H   -3.939600      -2.834700      0.7011000    
 H   -5.848100      0.6854000     -0.8126000    
 H   -5.121300      0.7810000      0.7903000    
 H   -1.770400      -1.631000      0.6580000    
 H   -2.487000      -1.738000     -0.9480000    
 H   -3.649700      0.4026000      -1.870500    
 H   -3.638100       1.824600     -0.8281000    
 H  -0.8708000      0.8235000       1.632100    
 H   0.7601000      -1.168400      0.4268000    
 H    3.308500       2.278000     -0.1406000    
 H    2.686300      -2.636300      0.1559000    
 H    5.240700      0.7903000     -0.4091000    
 H    4.972400      -2.884800     -0.7512000    
 H    6.016700      -1.485300     -0.9781000    
 H    5.734500      -2.116700      0.6614000    


%chk=000033065-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000033065

0 1
O 1.218761 1.100884 2.840678
N -2.454946 -0.421900 0.345108
N -1.110290 -0.273209 0.490404
C -5.281243 -0.882327 -0.220083
C -4.836261 0.205903 0.781695
C -4.211734 -1.043260 -1.323205
C -3.452324 -0.102460 1.397644
C -2.846165 -1.393746 -0.702562
C -0.573153 0.313859 1.555022
C 0.878224 0.542218 1.736331
C 1.942134 0.162665 0.740546
C 1.697905 -0.422114 -0.531755
C 3.291009 0.422031 1.115588
C 4.117310 -0.484700 -1.017328
C 2.772684 -0.735997 -1.391028
C 4.355479 0.105213 0.253992
C 5.270955 -0.850017 -1.933873
H -5.417106 -1.847722 0.309732
H -6.259166 -0.616502 -0.661886
H -4.786035 1.181854 0.261312
H -5.568807 0.309489 1.604159
H -4.495298 -1.841293 -2.034506
H -4.125067 -0.100270 -1.896939
H -3.103367 0.778474 1.963361
H -3.524415 -0.952630 2.113144
H -2.893564 -2.414561 -0.259909
H -2.039816 -1.391786 -1.453410
H -1.151916 0.681448 2.418179
H 0.668306 -0.623022 -0.834075
H 3.468012 0.878895 2.095063
H 2.564849 -1.183555 -2.371079
H 5.386609 0.316156 0.564117
H 4.932487 -0.998384 -2.973935
H 6.050739 -0.067055 -1.934200
H 5.755208 -1.790277 -1.604801


