%chk=000120927.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000120927

0 1
 O   -1.259600      0.5609000      0.8663000    
 O  -0.3265000      0.2212000      -1.248700    
 N    2.166700      0.6196000     -5.9799999E-02
 N    4.645400     -0.8651000      4.3400001E-02
 C    2.177000     -0.8327000      0.1540000    
 C    3.395400       1.223800      0.4696000    
 C    3.416200      -1.469000     -0.4852000    
 C    4.635100      0.5876000     -0.1683000    
 C   0.9853000       1.225700      0.5507000    
 C    1.007300       2.732300      0.3320000    
 C    5.826300      -1.470600     -0.5691000    
 C  -0.2454000      0.6102000     -9.0499997E-02
 C   -2.445800      7.7000000E-03  0.3782000    
 C   -2.636200      -1.353700      0.4850000    
 C   -3.383600      0.8415000     -0.1927000    
 C   -3.820400      -1.907300     -1.9000000E-03
 C   -4.567800      0.2881000     -0.6795000    
 C   -1.614100      -2.249200       1.104100    
 C   -3.169300       2.315200     -0.3035000    
 C   -4.786100      -1.086300     -0.5842000    
 H    1.311100      -1.327400     -0.2955000    
 H    2.159000      -1.068200       1.227300    
 H    3.447000       1.122400       1.562200    
 H    3.457400       2.290400      0.2309000    
 H    3.406900      -2.542700     -0.2614000    
 H    3.364600      -1.362100      -1.577300    
 H    4.663200      0.8270000      -1.240200    
 H    5.526600       1.034000      0.2891000    
 H   0.9607000       1.012500       1.628100    
 H   1.9400001E-02   3.159900      0.5421000    
 H    1.711900       3.242200      0.9967000    
 H    1.242600       2.993700     -0.7066000    
 H    6.741300      -1.048700     -0.1388000    
 H    5.854300      -1.320100      -1.654400    
 H    5.853000      -2.547600     -0.3696000    
 H   -4.003800      -2.976500      6.3100003E-02
 H   -5.329500      0.9136000      -1.137400    
 H  -0.8197000      -2.468800      0.3845000    
 H   -1.174000      -1.791000       1.996100    
 H   -2.056000      -3.199400       1.424000    
 H   -4.092100       2.839700     -0.5742000    
 H   -2.834500       2.731400      0.6526000    
 H   -2.420900       2.533200      -1.071900    
 H   -5.707700      -1.517400     -0.9641000    


%chk=000120927-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000120927

0 1
O -1.289401 0.363128 0.779580
O -0.279396 0.247574 -1.333922
N 2.276873 0.565460 0.036711
N 4.865241 -0.749828 -0.157684
C 2.397455 -0.917931 0.002391
C 3.495176 1.159480 0.645981
C 3.653790 -1.341519 -0.772473
C 4.748907 0.725514 -0.131566
C 1.015774 1.007184 0.675798
C 0.883836 2.551998 0.753308
C 6.108999 -1.206930 -0.805154
C -0.197150 0.490267 -0.118284
C -2.572941 -0.075030 0.292520
C -2.992437 -1.362167 0.708894
C -3.374449 0.799807 -0.479862
C -4.287167 -1.781765 0.317717
C -4.662265 0.336380 -0.849195
C -2.081994 -2.248508 1.535846
C -2.882810 2.171540 -0.895274
C -5.116381 -0.941629 -0.457955
H 1.512005 -1.336511 -0.506370
H 2.451049 -1.343072 1.036796
H 3.612395 0.851539 1.716435
H 3.427667 2.259654 0.606985
H 3.744318 -2.443819 -0.747194
H 3.537158 -1.026640 -1.840363
H 4.691531 1.152676 -1.165984
H 5.645372 1.145185 0.363099
H 0.905845 0.600513 1.713479
H -0.130425 2.823063 1.091793
H 1.598652 2.977656 1.476737
H 1.066752 2.998100 -0.239711
H 6.981628 -0.784851 -0.274498
H 6.183310 -0.912036 -1.883087
H 6.174510 -2.308470 -0.747789
H -4.640656 -2.772881 0.624507
H -5.308496 0.989682 -1.446765
H -1.174964 -2.533162 0.969356
H -1.737551 -1.729756 2.448361
H -2.601441 -3.174884 1.833524
H -3.709099 2.777961 -1.302326
H -2.440803 2.719099 -0.042705
H -2.102069 2.088419 -1.674034
H -6.115646 -1.280492 -0.752423


