%chk=000076465.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076465

0 1
 O    1.577500      0.7546000      0.9577000    
 O    2.383000     -0.9218000     -0.5207000    
 O   -2.383000     -0.9221000      0.5201000    
 O   -1.577200      0.7558000     -0.9565000    
 N    7.243600       1.276800     -0.3594000    
 N   -7.244100       1.276300      0.3593000    
 C    0.000000     -0.8532000     -9.9999997E-05
 C   0.3672000      3.7700001E-02   1.208800    
 C    1.218000      -1.727800     -0.3412000    
 C   -1.218000      -1.728100      0.3400000    
 C  -0.3669000      3.9000001E-02  -1.208200    
 C    2.647300     -0.1406000      0.6467000    
 C   -2.647000     -0.1398000     -0.6466000    
 C    3.886700      0.6946000      0.3750000    
 C   -3.886700      0.6950000     -0.3743000    
 C    5.095000     -0.1819000      5.0500002E-02
 C   -5.095100     -0.1819000     -5.0900001E-02
 C    6.294800      0.6339000     -0.1782000    
 C   -6.295100      0.6336000      0.1780000    
 H  -0.4145000      0.7741000       1.422900    
 H   0.4996000     -0.5630000       2.117600    
 H    1.415700      -2.463000      0.4491000    
 H    1.053100      -2.287000      -1.268700    
 H   -1.415700      -2.462500     -0.4509000    
 H   -1.053300      -2.288100       1.267000    
 H   0.4148000      0.7757000      -1.421300    
 H  -0.4992000     -0.5606000      -2.117700    
 H    2.832300     -0.8030000       1.503300    
 H   -2.831800     -0.8012000      -1.503800    
 H    3.694000       1.375600     -0.4654000    
 H    4.096400       1.337500       1.239800    
 H   -3.694100       1.375200      0.4667000    
 H   -4.096300       1.338700      -1.238700    
 H    4.902900     -0.7869000     -0.8428000    
 H    5.281800     -0.8779000      0.8766000    
 H   -4.903100     -0.7876000      0.8419000    
 H   -5.281500     -0.8772000     -0.8776000    


%chk=000076465-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076465

0 1
O 1.621283 0.792024 0.964915
O 2.438290 -0.926217 -0.519549
O -2.438225 -0.926672 0.518752
O -1.621236 0.792862 -0.964220
N 7.379132 1.232790 -0.433675
N -7.379170 1.232176 0.435394
C 0.000031 -0.836146 -0.000376
C 0.367616 0.050760 1.218612
C 1.219486 -1.733177 -0.326116
C -1.219424 -1.733464 0.324571
C -0.367568 0.051829 -1.218583
C 2.716800 -0.122063 0.678446
C -2.716752 -0.121472 -0.678533
C 3.961416 0.714358 0.405552
C -3.961346 0.714744 -0.404894
C 5.176153 -0.185769 0.054442
C -5.176055 -0.185626 -0.054313
C 6.394292 0.595458 -0.214971
C -6.394158 0.595432 0.215754
H -0.397831 0.818530 1.398734
H 0.486320 -0.579536 2.128207
H 1.383132 -2.463332 0.499649
H 1.084889 -2.287341 -1.270487
H -1.383096 -2.462863 -0.501857
H -1.084818 -2.288488 1.268434
H 0.397864 0.819766 -1.398057
H -0.486279 -0.577677 -2.128724
H 2.840933 -0.824023 1.541991
H -2.840911 -0.822672 -1.542691
H 3.739615 1.399765 -0.430187
H 4.173300 1.328242 1.297487
H -3.739453 1.399541 0.431322
H -4.173321 1.329284 -1.296355
H 4.930964 -0.797310 -0.832723
H 5.387812 -0.888872 0.883875
H -4.930787 -0.797796 0.832395
H -5.387800 -0.888144 -0.884219


