%chk=000003723.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003723

0 1
 I  -0.5910000       2.895300      -1.166000    
 I   -1.900700      -2.980900     -0.2254000    
 I    3.878200      -1.046900      0.1541000    
 O    1.310700      -3.282500       1.535400    
 O    1.654100      -3.880500     -0.6304000    
 O   -5.164100      0.7648000     -0.5647000    
 O    2.421600       2.520300       1.645300    
 N   -3.029600      0.5183000      0.3338000    
 N    2.338600       1.692600     -0.5590000    
 C  -0.8865000     -0.1141000     -0.6365000    
 C   -2.339800      0.1710000     -0.8785000    
 C   4.8400000E-02  0.9186000     -0.7098000    
 C    1.399300      0.6537000     -0.4847000    
 C  -0.4706000      -1.411600     -0.3381000    
 C   0.8802000      -1.676500     -0.1130000    
 C    1.815200     -0.6439000     -0.1863000    
 C    1.316300      -3.038400      0.2000000    
 C   -4.390700      0.7873000      0.3892000    
 C    2.774000       2.530500      0.4702000    
 C   -4.860200       1.098600       1.785000    
 C    3.796700       3.524400     -2.0600000E-02
 H   -2.512600      0.9626000      -1.612700    
 H   -2.871900     -0.6554000      -1.357800    
 H   -2.493400      0.5682000       1.196100    
 H    2.644800       1.915700      -1.503600    
 H   -5.879000       1.494200       1.751700    
 H   -4.847700      0.1852000       2.385900    
 H   -4.208900       1.847000       2.245400    
 H    4.605700       3.005000     -0.5422000    
 H    4.218800       4.070200      0.8277000    
 H    3.319600       4.234700     -0.7014000    
 H    1.604000      -4.195600       1.741700    


%chk=000003723-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003723

0 1
I -0.304143 2.999933 -1.521628
I -2.073639 -2.809233 -0.173033
I 3.848229 -1.224324 0.059497
O 1.159477 -3.410000 1.388436
O 1.443766 -3.960722 -0.855083
O -4.956779 -0.388187 -0.030109
O 1.786039 2.797601 1.264273
N -3.010129 0.840800 0.315529
N 2.510189 1.644402 -0.634601
C -0.930668 0.034339 -0.752643
C -2.387142 0.433538 -0.955646
C 0.122747 0.985353 -0.872130
C 1.482698 0.658718 -0.607342
C -0.560984 -1.299674 -0.417809
C 0.790165 -1.681766 -0.228163
C 1.796304 -0.693691 -0.307512
C 1.159636 -3.123423 0.025096
C -4.272169 0.394724 0.694466
C 2.625125 2.660434 0.334943
C -4.766073 0.905928 2.044260
C 3.814601 3.588762 0.130298
H -2.448873 1.254264 -1.692905
H -2.995580 -0.403208 -1.339016
H -2.512932 1.512768 0.903553
H 3.291581 1.503738 -1.279574
H -5.743570 1.398623 1.906951
H -4.924660 0.043989 2.715365
H -4.071637 1.611891 2.531157
H 4.156127 3.951173 1.111854
H 3.492679 4.465464 -0.462005
H 4.657725 3.106464 -0.395025
H 1.401391 -4.366779 1.529346


