%chk=000162549.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162549

0 1
 O    1.829800     -0.8906000     -0.2123000    
 O    2.736000       1.000700      0.7581000    
 N   -2.273100      0.2274000     -0.3832000    
 C   -1.270100       1.302100     -0.1283000    
 C   -1.940300      -1.165900      3.3799998E-02
 C   0.1711000      0.8340000     -0.4498000    
 C  -0.4708000      -1.530300     -0.2940000    
 C   0.5237000     -0.4942000      0.1946000    
 C   -1.305600       1.878800       1.305400    
 C   -1.538600       2.488000      -1.096100    
 C   -2.214900      -1.466700       1.525000    
 C   -2.801200      -2.162700     -0.7911000    
 C   -3.653500      0.6222000     -7.9099998E-02
 C    2.840900     -4.6100002E-02  0.1386000    
 C    4.106200     -0.6177000     -0.3665000    
 C    5.260500      2.1100000E-02 -0.1551000    
 H   0.8572000       1.641900     -0.1845000    
 H   0.2912000      0.7273000      -1.539000    
 H  -0.3456000      -1.651800      -1.380400    
 H  -0.2079000      -2.510200      0.1276000    
 H   0.5057000     -0.4344000       1.288400    
 H  -0.5753000       2.690700       1.412700    
 H   -2.282300       2.307100       1.553500    
 H   -1.059600       1.138100       2.067100    
 H   -1.631600       2.141600      -2.132300    
 H   -2.447500       3.042100     -0.8406000    
 H  -0.7163000       3.213700      -1.068100    
 H   -3.266800      -1.315000       1.789000    
 H   -1.985800      -2.514700       1.754900    
 H   -1.608600     -0.8611000       2.199500    
 H   -2.742800      -1.944200      -1.864000    
 H   -2.452000      -3.193000     -0.6493000    
 H   -3.856100      -2.150400     -0.4986000    
 H   -3.928900       1.559800     -0.5695000    
 H   -3.830900      0.7408000      0.9942000    
 H   -4.379500     -0.1011000     -0.4601000    
 H    4.082900      -1.557000     -0.9075000    
 H    6.189300     -0.3993000     -0.5263000    
 H    5.316500      0.9615000      0.3820000    


%chk=000162549-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162549

0 1
O 1.875655 -0.725381 -0.464887
O 2.898400 0.583282 1.189744
N -2.293744 0.222981 -0.413151
C -1.364095 1.387676 -0.156260
C -1.906171 -1.157929 0.061204
C 0.084356 0.986886 -0.565514
C -0.434725 -1.451523 -0.358938
C 0.519976 -0.339557 0.059855
C -1.374771 1.923815 1.314048
C -1.767365 2.563786 -1.092590
C -2.079112 -1.390462 1.599368
C -2.784779 -2.208534 -0.677738
C -3.723485 0.541332 -0.212762
C 2.983053 -0.184159 0.197413
C 4.235927 -0.664897 -0.444289
C 5.454785 -0.288749 0.021676
H 0.773721 1.796344 -0.265733
H 0.125822 0.880660 -1.666516
H -0.390800 -1.553977 -1.459841
H -0.121128 -2.414077 0.085239
H 0.616055 -0.249692 1.157047
H -0.836421 2.888293 1.365595
H -2.409502 2.099097 1.660964
H -0.886280 1.236584 2.024626
H -1.960797 2.186039 -2.112152
H -2.662070 3.102720 -0.733808
H -0.942309 3.297609 -1.139288
H -3.093886 -1.102890 1.929654
H -1.944249 -2.462254 1.837340
H -1.352569 -0.819585 2.200896
H -2.843729 -1.963573 -1.752929
H -2.331499 -3.210920 -0.570391
H -3.808734 -2.268509 -0.268147
H -3.983358 1.462576 -0.757942
H -4.027834 0.683206 0.852300
H -4.349658 -0.262076 -0.632742
H 4.116392 -1.333437 -1.303209
H 6.380879 -0.640403 -0.444671
H 5.533452 0.382197 0.885229


