%chk=000015557.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015557

0 1
 O   -2.991300      0.1128000      -2.426300    
 O    1.115100      -2.394500      0.1600000    
 O    1.147500       2.391900      0.3304000    
 O    2.438200     -2.7500000E-02  0.7237000    
 O    4.649800     -2.7500000E-02  0.3078000    
 O    3.197600      4.6200000E-02  -1.480900    
 N   -3.863500      4.9600001E-02 -0.2751000    
 C   -5.121800     -0.4079000       1.664400    
 C   -6.043500      0.1862000      0.6068000    
 C   -3.739500      7.0000002E-03   1.180600    
 C   -5.260000     -2.3499999E-02 -0.6795000    
 C   -2.837700      7.7200003E-02  -1.207000    
 C   -1.456300      4.9500000E-02 -0.7000000    
 C  -0.7991000       1.244000     -0.4193000    
 C  -0.8148000      -1.170300     -0.5061000    
 C   0.4951000      -1.196000     -2.7300000E-02
 C   0.5109000       1.218300      5.9300002E-02
 C    1.158000     -1.7000000E-03  0.2554000    
 C   0.9732000      -3.004300       1.441400    
 C    1.014700       2.910700       1.652200    
 C    3.418900      1.5000000E-03 -0.2773000    
 C    5.762300     -2.3000001E-03 -0.5925000    
 C    7.046000     -3.9400000E-02  0.2091000    
 H   -5.209300      -1.501100       1.660300    
 H   -5.340200     -4.8900001E-02   2.673800    
 H   -6.179700       1.258100      0.7941000    
 H   -7.028900     -0.2868000      0.5825000    
 H   -2.958900     -0.6895000       1.497300    
 H   -3.480600       1.015400       1.521300    
 H   -5.481300      0.7257000      -1.445500    
 H   -5.434400      -1.020200      -1.099900    
 H   -1.301100       2.196400     -0.5722000    
 H   -1.329200      -2.102700     -0.7264000    
 H    1.526500      -3.947400       1.435200    
 H  -7.9999998E-02  -3.217300       1.650100    
 H    1.388500      -2.360100       2.222800    
 H  -3.5399999E-02   3.122700       1.877200    
 H    1.421500       2.206800       2.385100    
 H    1.580900       3.844200       1.712400    
 H    5.726400      0.9143000      -1.191700    
 H    5.714800     -0.8730000      -1.255900    
 H    7.088200     -0.9419000      0.8276000    
 H    7.099500      0.8158000      0.8907000    
 H    7.918900     -2.1400001E-02 -0.4494000    


%chk=000015557-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000015557

0 1
O -3.264998 -1.449471 -1.833476
O 1.395729 -2.636071 -0.176113
O 0.684083 2.131897 0.932372
O 2.452774 -0.159926 0.793962
O 4.601583 0.074397 0.273582
O 3.030604 0.284952 -1.463267
N -4.078699 0.070232 -0.295870
C -5.593271 0.636475 1.451622
C -6.357841 0.688700 0.104053
C -4.117563 0.783263 1.011434
C -5.450482 -0.115119 -0.855737
C -3.039344 -0.649312 -0.863298
C -1.635370 -0.480891 -0.331185
C -1.129045 0.746694 0.159432
C -0.782259 -1.608555 -0.415042
C 0.563064 -1.514502 -0.012059
C 0.223497 0.859518 0.551043
C 1.070734 -0.270775 0.448001
C 2.034181 -3.160840 1.053244
C 1.367730 2.235718 2.241871
C 3.339200 0.088115 -0.277797
C 5.711252 0.330501 -0.704783
C 7.010746 0.252452 0.086095
H -5.747926 -0.342732 1.941360
H -5.899003 1.428757 2.155850
H -6.449518 1.736189 -0.238105
H -7.372186 0.260967 0.167468
H -3.400423 0.341627 1.723360
H -3.865655 1.855969 0.887373
H -5.488782 0.236769 -1.901012
H -5.697445 -1.193852 -0.868561
H -1.741249 1.650525 0.206470
H -1.159221 -2.548165 -0.827116
H 2.648180 -4.008908 0.715176
H 1.260622 -3.514963 1.761194
H 2.669098 -2.397013 1.535211
H 0.675107 1.948461 3.056365
H 2.272509 1.606101 2.277674
H 1.636054 3.298614 2.336164
H 5.546345 1.324366 -1.158185
H 5.648989 -0.432827 -1.500817
H 7.134546 -0.743123 0.544723
H 7.033314 1.011632 0.886110
H 7.866339 0.433256 -0.589588


