%chk=000003479.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003479

0 1
 O  -0.4952000      -1.555500      -1.612300    
 O   0.7160000      -1.859400       1.822100    
 O    2.180000     -0.5606000      -1.192000    
 O   -3.170400       1.142900      0.2276000    
 O   0.8409000       3.137600      3.0800000E-02
 N  -0.4543000      0.8985000      0.1955000    
 N    1.588600       1.996100      5.2900001E-02
 C  -0.5915000      -1.567700     -0.1922000    
 C   0.8045000      -1.692500      0.4097000    
 C   -1.273700     -0.3053000      0.3405000    
 C    1.635000     -0.4512000      0.1194000    
 C   0.8356000      0.8479000      0.1341000    
 C   -2.615500     -3.0700000E-02 -0.3362000    
 H   -1.200300      -2.435000      9.1200002E-02
 H    1.300600      -2.579600     -2.7000001E-03
 H   -1.462900     -0.4232000       1.415900    
 H    2.470200     -0.3554000      0.8219000    
 H   -3.313300     -0.8581000     -0.1756000    
 H   -2.508400      0.1295000      -1.414100    
 H  -0.1001000      -2.400800      -1.886600    
 H    1.618000      -1.993200       2.160100    
 H    1.446500     -0.6816000      -1.818600    
 H    2.594900       2.056200     -4.5899998E-02
 H   -2.542700       1.869300      7.2600000E-02
 H    1.278200       3.678400      0.7101000    


%chk=000003479-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003479

0 1
O -0.167992 -1.482916 -1.614985
O 0.608845 -1.822820 1.940422
O 2.412609 -0.650487 -1.154474
O -3.128794 1.224166 0.240920
O 0.924099 3.181235 -0.084420
N -0.351767 0.929440 0.248776
N 1.699176 1.977411 0.144129
C -0.486444 -1.558084 -0.165945
C 0.891100 -1.712402 0.507051
C -1.187762 -0.288616 0.369428
C 1.779756 -0.486059 0.164896
C 0.961662 0.806387 0.196182
C -2.544571 0.007614 -0.308827
H -1.108905 -2.450763 0.036664
H 1.400151 -2.615111 0.113993
H -1.385947 -0.472230 1.444958
H 2.621460 -0.420400 0.877097
H -3.266795 -0.802513 -0.106863
H -2.419121 0.111899 -1.413741
H -0.959646 -1.168946 -2.117138
H 1.432150 -2.082017 2.423287
H 1.664334 -0.899147 -1.773511
H 2.584521 2.012343 -0.370136
H -2.373470 1.866828 0.333859
H -0.017950 2.801790 -0.003420


