%chk=000004883.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004883

0 1
 O   -1.291800      -1.599000     -0.4788000    
 O   -3.954900      -2.294100     -0.8745000    
 O    4.577400       1.119300      -1.304500    
 N   -3.357000       1.028900      0.6456000    
 N    3.917400     -5.3399999E-02  0.6314000    
 C   -3.743000      3.7300002E-02 -0.3492000    
 C   -3.592800      -1.392600      0.1755000    
 C   -3.455300       2.376900      0.1025000    
 C   -2.173800      -1.723200      0.6326000    
 C   -3.092700       3.388300       1.185300    
 C   -2.544700       2.525200      -1.113100    
 C  -6.2000002E-03  -1.216400     -0.2042000    
 C   0.7128000     -0.4893000      -1.146900    
 C   0.5696000      -1.559600       1.014300    
 C    2.606700     -0.4418000      0.3524000    
 C    2.023200     -0.1009000     -0.8678000    
 C    1.879900      -1.171200       1.293500    
 C    4.795400      0.6756000     -0.1818000    
 C    6.129600      0.8902000      0.4878000    
 H   -3.142500      0.1007000      -1.262300    
 H   -4.784500      0.1936000     -0.6590000    
 H   -4.284300      -1.561900       1.009600    
 H   -4.489300       2.581100     -0.2037000    
 H   -3.951200      0.9387000       1.469200    
 H   -2.136900      -2.764600      0.9741000    
 H   -1.906300      -1.061000       1.464900    
 H   -2.062400       3.251500       1.533200    
 H   -3.186200       4.412100      0.8071000    
 H   -3.757700       3.294700       2.051300    
 H   -2.946400       2.029800      -2.002400    
 H   -1.537400       2.139100     -0.9184000    
 H   -2.438000       3.583300      -1.380300    
 H   -4.875300      -2.100800      -1.122000    
 H   0.2602000     -0.2214000      -2.097500    
 H   5.0700001E-02  -2.153600       1.760500    
 H    2.521600      0.4613000      -1.645100    
 H    2.325000      -1.449600       2.245500    
 H    4.270900     -0.3405000       1.541800    
 H    5.993500       1.470700       1.404600    
 H    6.797600       1.436900     -0.1836000    
 H    6.583100     -7.5099997E-02  0.7299000    


%chk=000004883-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004883

0 1
O -1.221014 -0.825691 -0.400174
O -3.588355 -2.508983 -0.789010
O 5.131765 0.531770 -1.631344
N -4.130459 1.001498 0.516833
N 4.354944 -0.262670 0.439269
C -3.988914 -0.057654 -0.499190
C -3.524522 -1.381178 0.153882
C -3.934384 2.406793 0.058262
C -2.091910 -1.316606 0.677104
C -4.561130 3.357569 1.098222
C -2.431298 2.707440 -0.130360
C 0.148337 -0.713106 -0.127121
C 0.953355 -0.252882 -1.198566
C 0.752082 -1.019617 1.118166
C 2.952504 -0.397529 0.202653
C 2.341049 -0.092296 -1.045825
C 2.145089 -0.860131 1.271488
C 5.349856 0.173382 -0.434672
C 6.757565 0.190463 0.162183
H -3.230855 0.243915 -1.240094
H -4.938604 -0.254592 -1.060944
H -4.178487 -1.591212 1.032563
H -4.449931 2.577609 -0.919885
H -4.997382 0.901219 1.060951
H -1.770909 -2.329544 0.990683
H -2.058268 -0.615980 1.534556
H -4.098199 3.194223 2.089235
H -4.398789 4.410829 0.809653
H -5.652720 3.195459 1.191177
H -1.949041 1.973908 -0.800179
H -1.913129 2.658997 0.844499
H -2.286889 3.715237 -0.562420
H -4.425602 -2.441827 -1.315032
H 0.470496 -0.028636 -2.154822
H 0.159754 -1.377969 1.964346
H 2.961505 0.262306 -1.870401
H 2.604254 -1.100826 2.239645
H 4.662975 -0.522994 1.378432
H 7.160749 1.215912 0.098371
H 7.412167 -0.455857 -0.447681
H 6.806344 -0.145547 1.213048


