%chk=000156979.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156979

0 1
 O    3.169800       1.952000      0.2154000    
 O    3.882100     -0.2303000     -0.5182000    
 O  -1.3500000E-02  -3.330400      0.1714000    
 O   -1.808700      -2.013100     -0.2856000    
 N   -3.717900       1.227600      3.1500001E-02
 C   -1.496800      0.5060000      0.8467000    
 C  -7.2400004E-02  0.2533000      0.4702000    
 C   -2.336400      0.9603000     -0.3540000    
 C   0.3431000      -1.019900      4.2199999E-02
 C   0.8392000       1.308600      0.5523000    
 C    2.148400       1.052700      0.2000000    
 C    2.555100     -0.1934000     -0.2191000    
 C    1.675100      -1.252400     -0.3087000    
 C    4.265500       1.131900     -0.2398000    
 C   -4.353700      1.2500000E-02  0.5430000    
 C   -4.475300       1.758600      -1.102800    
 C  -0.6036000      -2.123900     -4.4599999E-02
 H   -1.896400     -0.3624000       1.376800    
 H   -1.521100       1.301000       1.606900    
 H   -2.288400      0.2334000      -1.174200    
 H   -1.892100       1.885300     -0.7467000    
 H   0.5369000       2.298300      0.8778000    
 H    2.028300      -2.218200     -0.6545000    
 H    5.044100       1.126800      0.5317000    
 H    4.678600       1.574000      -1.153700    
 H   -3.954700     -0.2865000       1.516200    
 H   -4.274800     -0.8278000     -0.1557000    
 H   -5.421100      0.1923000      0.7212000    
 H   -4.526000       1.047800      -1.935700    
 H   -4.022400       2.687100      -1.468200    
 H   -5.498200       2.009200     -0.8000000    
 H  -0.6576000      -4.067800      0.1106000    


%chk=000156979-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000156979

0 1
O 3.227303 2.003490 0.139360
O 3.994999 -0.181339 -0.508297
O 0.144792 -3.440367 -0.197588
O -1.759393 -2.281235 0.404317
N -3.780895 1.166978 -0.006500
C -1.521318 0.548516 0.911719
C -0.079596 0.230545 0.549022
C -2.386273 0.813478 -0.355071
C 0.382511 -1.073411 0.160019
C 0.846092 1.315319 0.562085
C 2.168634 1.075476 0.191395
C 2.613220 -0.209635 -0.188721
C 1.752100 -1.295832 -0.210049
C 4.419158 1.229622 -0.321069
C -4.583053 0.004241 0.431360
C -4.459727 1.921060 -1.079757
C -0.527055 -2.246657 0.148328
H -1.969932 -0.280682 1.479891
H -1.560255 1.459298 1.535478
H -2.335025 -0.080022 -1.024754
H -1.946039 1.665441 -0.907899
H 0.517418 2.314839 0.858935
H 2.085602 -2.294416 -0.493728
H 5.194578 1.275340 0.462001
H 4.755227 1.640374 -1.288405
H -4.083937 -0.517121 1.263867
H -4.744139 -0.744522 -0.384495
H -5.570652 0.351994 0.784802
H -4.601134 1.331326 -2.021917
H -3.878382 2.827388 -1.327262
H -5.458302 2.241587 -0.730582
H -0.521430 -4.178473 -0.184085


