%chk=000164437.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164437

0 1
 O    2.346300      0.8300000     -0.9659000    
 O    1.443000       2.703400       1.374100    
 O    3.963400       1.972500       2.030700    
 O    4.527400     -0.3370000      -1.619800    
 N   0.6699000     -0.5520000      6.6999998E-03
 N    5.855700      0.9677000     -0.2226000    
 N   0.5882000      -2.781800     -2.0800000E-02
 N   -1.685300     -5.5700000E-02  0.3370000    
 N   -3.011800      -2.099000      0.4836000    
 N   -2.038200      -4.277800      0.3139000    
 C    1.740700       1.309400       1.299000    
 C    1.234000      0.7980000     -4.6700001E-02
 C    3.237100       1.090400       1.199100    
 C    3.495200       1.334700     -0.2740000    
 C    4.661700      0.5620000     -0.7939000    
 C  -0.6442000     -0.8871000      0.1806000    
 C    1.369300      -1.725600     -0.1099000    
 C  -0.6730000      -2.272300      0.1610000    
 C    7.129300      0.3628000     -0.5392000    
 C   -1.915300      -2.877900      0.3208000    
 C   -2.831300     -0.7561000      0.4816000    
 C    6.969500     -0.7503000      -1.560800    
 C   -4.011000      2.2200000E-02  0.6571000    
 C   -7.157500       1.395000     -0.2445000    
 C   -6.229000       1.487900      0.9678000    
 C   -6.522600       1.946900      -1.524300    
 C   -5.011800      0.6826000      0.7991000    
 C   -7.499300       1.907100      -2.689400    
 H    1.296600      0.8262000       2.174600    
 H   0.4550000       1.442400     -0.4708000    
 H    3.489000      5.8499999E-02   1.473500    
 H    3.621800       2.396600     -0.5152000    
 H   0.4752000       2.791900       1.412100    
 H    3.663700       1.825500       2.944000    
 H    2.440500      -1.756500     -0.2517000    
 H    5.851800       1.727200      0.4520000    
 H    7.786000       1.151100     -0.9195000    
 H    7.555400     -2.0400001E-02  0.3929000    
 H    6.373700      -1.589900      -1.188100    
 H    6.609400     -0.3917000      -2.530600    
 H    7.963800      -1.169800      -1.760600    
 H   -2.951900      -4.693600      0.4324000    
 H   -1.221800      -4.861800      0.1931000    
 H   -7.452900      0.3503000     -0.4059000    
 H   -8.074600       1.955100     -2.4200000E-02
 H   -5.958300       2.534900       1.147100    
 H   -6.770100       1.143500       1.856700    
 H   -5.633000       1.367200      -1.794000    
 H   -6.200200       2.982000      -1.362300    
 H   -7.819600      0.8812000      -2.897600    
 H   -7.027800       2.305900      -3.593100    
 H   -8.388700       2.508800      -2.476900    


%chk=000164437-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000164437

0 1
O 2.546155 0.605453 -1.720458
O 1.320200 2.936991 -0.054475
O 3.438825 2.312793 1.382276
O 4.556064 -1.257207 -1.117812
N 0.738976 -0.689007 -0.814737
N 5.751209 0.334796 0.114129
N 0.583607 -2.972790 -0.704311
N -1.539646 -0.073817 -0.061833
N -2.902385 -2.067849 0.443533
N -2.086833 -4.271321 0.229597
C 1.378528 1.494675 0.204108
C 1.231163 0.676469 -1.104732
C 2.847849 1.222769 0.627797
C 3.575415 0.989709 -0.739033
C 4.667697 -0.094866 -0.626335
C -0.559096 -0.966562 -0.372819
C 1.383897 -1.929678 -1.006829
C -0.631651 -2.382819 -0.311010
C 6.913339 -0.523693 0.410574
C -1.878373 -2.922425 0.122722
C -2.699460 -0.706292 0.342185
C 8.228113 0.057168 -0.147616
C -3.808253 0.134701 0.698353
C -7.132377 1.535456 0.415868
C -5.918591 1.688916 1.380416
C -6.835698 2.005522 -1.025184
C -4.764000 0.853983 1.008245
C -8.057894 1.859656 -1.956597
H 0.632940 1.193941 0.959091
H 0.534511 1.157747 -1.813370
H 2.905534 0.326418 1.265961
H 4.020445 1.947596 -1.070132
H 0.379700 3.236782 -0.095503
H 2.974948 3.141630 1.072235
H 2.419448 -1.979294 -1.346286
H 5.706732 1.267980 0.537174
H 6.992660 -0.667817 1.505906
H 6.696100 -1.505494 -0.042971
H 8.172103 0.163690 -1.244775
H 8.451134 1.049353 0.287116
H 9.071905 -0.614501 0.093802
H -2.994687 -4.608445 0.542326
H -1.337677 -4.917858 -0.008694
H -7.451721 0.475289 0.401768
H -7.976462 2.122646 0.830963
H -5.609296 2.753417 1.407801
H -6.234548 1.423521 2.409362
H -5.985533 1.421673 -1.428119
H -6.507061 3.065002 -1.002720
H -8.382472 0.804051 -2.020593
H -7.826292 2.203459 -2.981263
H -8.915792 2.453086 -1.586901


