%chk=000096709.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096709

0 1
 O  -0.2299000       3.548600      2.4999999E-03
 O    2.148000       3.787100     -0.1715000    
 O   -3.975700      -2.095800      0.2754000    
 O    3.475900      -1.278500       1.007300    
 O    3.442800      -1.423100      -1.290000    
 O    1.180900      -3.027400      -1.200800    
 O    1.340100      -3.027200      0.9887000    
 N   0.9276000      -2.528900     -8.1900001E-02
 C  -0.2500000       1.068800      3.3000000E-03
 C   0.6402000     -4.1299999E-02 -6.1500002E-02
 C   -1.676000      0.8212000      0.1071000    
 C   0.3854000       2.328600     -4.3000001E-02
 C   -2.139800     -0.5212000      0.1414000    
 C   0.1353000      -1.342000     -2.4400000E-02
 C    2.039300      0.1410000     -0.1637000    
 C    1.755600       2.483700     -0.1431000    
 C   -1.230800      -1.578400      7.5400002E-02
 C    2.608100       1.409500     -0.2055000    
 C   -2.674600       1.826600      0.1792000    
 C   -3.511900     -0.8097000      0.2413000    
 C   0.8814000       4.456400     -7.8900002E-02
 C   -4.037200       1.527500      0.2782000    
 C   -4.456400      0.2080000      0.3097000    
 C    3.042800     -0.9211000     -0.2369000    
 C   -4.286100      -2.700400     -0.9759000    
 C    4.464900      -2.311900       1.067600    
 H   -1.580000      -2.610000      0.1102000    
 H    3.680200       1.559800     -0.2840000    
 H   -2.420100       2.880900      0.1601000    
 H   0.8823000       5.092400      0.8136000    
 H   0.7525000       5.092200     -0.9622000    
 H   -4.765300       2.331800      0.3309000    
 H   -5.515300     -2.1000000E-02  0.3879000    
 H   -4.537000      -3.749500     -0.7965000    
 H   -3.433500      -2.658500      -1.661100    
 H   -5.152100      -2.208300      -1.429800    
 H    4.587000      -2.604600       2.113700    
 H    5.419200      -1.930000      0.6936000    
 H    4.151700      -3.188800      0.4930000    


%chk=000096709-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096709

0 1
O -0.249997 3.473507 0.124677
O 2.102369 3.778938 0.401915
O -3.860761 -2.222484 -0.582152
O 4.338611 -0.856976 0.626088
O 2.959601 -1.999661 -0.861338
O 0.470605 -3.872058 0.368625
O 1.765544 -2.517887 1.661063
N 0.845553 -2.707116 0.769420
C -0.192814 0.926604 0.095848
C 0.732404 -0.197466 0.197082
C -1.625040 0.718579 -0.133349
C 0.397765 2.210980 0.200303
C -2.109642 -0.632845 -0.234845
C 0.120962 -1.516111 0.255895
C 2.153373 0.033281 0.232445
C 1.776637 2.401603 0.358424
C -1.222988 -1.729253 0.006278
C 2.681127 1.339353 0.345754
C -2.555646 1.791564 -0.286225
C -3.503544 -0.875687 -0.501186
C 0.799007 4.477247 0.465770
C -3.907526 1.522487 -0.543826
C -4.398915 0.195278 -0.657352
C 3.136004 -1.059558 -0.048490
C -5.265451 -2.549277 -0.847913
C 5.374346 -1.890036 0.382421
H -1.623095 -2.744545 0.045881
H 3.759246 1.499437 0.389817
H -2.214346 2.823560 -0.212518
H 0.623508 4.836957 1.496908
H 0.778738 5.281152 -0.285191
H -4.606534 2.357159 -0.665376
H -5.459182 0.024900 -0.861798
H -5.302003 -3.647648 -0.870408
H -5.589778 -2.142584 -1.824577
H -5.922917 -2.167204 -0.043797
H 6.217098 -1.596029 1.023372
H 5.663790 -1.900213 -0.682077
H 4.983389 -2.881448 0.663834


