%chk=000030789.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030789

0 1
 I  -0.3565000       2.324700      0.8993000    
 I   -2.752500      -3.007700     -0.9262000    
 I    2.996300      -2.778800      0.6126000    
 O   -3.398400     -0.3606000       1.968600    
 O    3.396700     -0.7451000      -1.621400    
 O    5.121200     -0.3139000     -0.2123000    
 N   -2.551600      0.1760000     -0.1550000    
 C   -2.921600      0.5658000      -1.526500    
 C   -3.951700       1.680200      -1.602300    
 C   -5.131400       1.326900     -0.7240000    
 C   -4.651700       1.195800      0.7051000    
 C    3.081300       1.000000     -5.2999998E-03
 C   -1.273100     -0.4755000      2.9500000E-02
 C    2.251500      0.3855000       1.137300    
 C   -3.484500      0.2424000      0.8954000    
 C    1.051100     -0.3909000      0.6506000    
 C  -0.1700000      0.2505000      0.4790000    
 C    3.925600       2.175500      0.5203000    
 C   -1.146900      -1.837200     -0.2453000    
 C    1.185200      -1.747300      0.3790000    
 C   8.2300000E-02  -2.473100     -7.0500001E-02
 C    3.987700     -6.6799998E-02 -0.6049000    
 C    4.711100       2.873800     -0.5829000    
 H   -3.327300     -0.3092000      -2.040700    
 H   -2.015900      0.8729000      -2.063200    
 H   -4.275700       1.818900      -2.639500    
 H   -3.506700       2.626500      -1.271500    
 H   -5.584700      0.3865000      -1.060000    
 H   -5.900000       2.104200     -0.7913000    
 H   -5.482800      0.8498000       1.330600    
 H   -4.336800       2.173200       1.090200    
 H    2.434400       1.383100     -0.8049000    
 H    1.949900       1.156500       1.852600    
 H    2.889800     -0.2289000       1.782400    
 H    4.624200       1.832000       1.293200    
 H    3.268100       2.915200      0.9928000    
 H   0.1809000      -3.535200     -0.2853000    
 H    5.458900       2.215600      -1.034200    
 H    5.238600       3.741400     -0.1734000    
 H    4.042600       3.229100      -1.373700    
 H    3.985400      -1.438000      -1.989700    


%chk=000030789-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000030789

0 1
I -0.308700 2.325986 0.819599
I -2.954847 -3.031679 -0.595838
I 2.870897 -3.071374 1.042753
O -3.261303 -0.204126 2.018055
O 2.920977 -0.425917 -1.897582
O 4.968169 -0.327909 -0.810477
N -2.521491 0.215430 -0.144725
C -2.683341 0.722330 -1.540367
C -3.821083 1.750008 -1.651508
C -5.083703 1.227139 -0.938698
C -4.782167 1.037574 0.562270
C 3.078540 1.066163 0.000275
C -1.303693 -0.495517 0.135319
C 2.359296 0.323589 1.186521
C -3.483695 0.293457 0.875785
C 1.120717 -0.459511 0.789932
C -0.124453 0.188315 0.537231
C 4.080974 2.108972 0.551986
C -1.231196 -1.905054 0.004429
C 1.109233 -1.877878 0.659583
C -0.039485 -2.601427 0.277988
C 3.782922 0.060525 -0.901394
C 4.727638 2.979751 -0.545588
H -2.879928 -0.138330 -2.212469
H -1.723517 1.177053 -1.848981
H -4.015639 1.939833 -2.723253
H -3.506501 2.708679 -1.195132
H -5.394396 0.264826 -1.390810
H -5.926898 1.930556 -1.066361
H -5.588478 0.491657 1.082527
H -4.704212 2.025008 1.060599
H 2.309694 1.576544 -0.608140
H 2.076431 1.105730 1.915388
H 3.089655 -0.336094 1.686089
H 4.870224 1.583470 1.122768
H 3.534016 2.756575 1.265400
H -0.006803 -3.689307 0.195608
H 5.329828 2.365097 -1.237931
H 5.399990 3.734489 -0.099593
H 3.960664 3.517389 -1.134825
H 3.398664 -1.118221 -2.431936


