%chk=000162109.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162109

0 1
 O   -2.542900       2.208700     -8.5699998E-02
 N   1.1000000E-02 -0.1384000     -0.1047000    
 N    3.720100     -8.6000003E-03 -0.4279000    
 N    7.248100     -5.7000000E-02  0.7720000    
 C    1.297200     -2.8000001E-02 -0.7744000    
 C    2.429400     -0.1015000      0.2457000    
 C   -1.084600     -4.2599998E-02  -1.070000    
 C    4.812500     -8.7300003E-02  0.5312000    
 C   -2.424100     -0.1620000     -0.4213000    
 C    6.153700      4.0000002E-03 -0.1906000    
 C   -3.094400      0.9694000      4.3800000E-02
 C   -3.003800      -1.422900     -0.2811000    
 C   -4.344300      0.8398000      0.6492000    
 C   -4.253800      -1.552500      0.3243000    
 C   -4.924000     -0.4211000      0.7894000    
 H    1.410500     -0.8421000      -1.501400    
 H    1.359400      0.9212000      -1.321800    
 H    2.324600      0.7142000      0.9725000    
 H    2.362700      -1.050100      0.7934000    
 H  -0.9848000     -0.8361000      -1.822900    
 H   -1.024300      0.9004000      -1.628600    
 H  -7.7299997E-02  0.6088000      0.5841000    
 H    3.776600      0.8677000     -0.9462000    
 H    4.759500      -1.035700       1.080600    
 H    4.731000      0.7280000       1.261400    
 H    6.228700      0.9421000     -0.7518000    
 H    6.262900     -0.8172000     -0.9078000    
 H   -2.492300      -2.313600     -0.6366000    
 H   -4.877900       1.712500       1.016200    
 H   -4.705000      -2.534300      0.4341000    
 H   -5.897200     -0.5222000       1.260900    
 H    7.185000     -0.9218000       1.308200    
 H    7.151800      0.6993000       1.448900    
 H   -3.150000       2.867500      0.2929000    


%chk=000162109-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000162109

0 1
O -2.073005 1.915145 0.339360
N -0.039343 -0.181626 -0.152780
N 3.728617 0.037725 -0.331421
N 7.416849 0.159427 0.704186
C 1.298212 -0.180729 -0.779465
C 2.394256 -0.058506 0.294494
C -1.146473 -0.322427 -1.131999
C 4.865641 0.075500 0.608779
C -2.512860 -0.316269 -0.466412
C 6.217653 0.110904 -0.152131
C -2.966496 0.819760 0.256169
C -3.389567 -1.421846 -0.554279
C -4.241735 0.855478 0.862899
C -4.672718 -1.406878 0.042131
C -5.098281 -0.262826 0.752228
H 1.440846 -1.130240 -1.328843
H 1.426831 0.645913 -1.530669
H 2.159310 0.815685 0.958136
H 2.367323 -0.958068 0.936836
H -1.011909 -1.281795 -1.666750
H -1.119437 0.487076 -1.906572
H -0.187139 0.667544 0.412875
H 3.770988 0.815321 -1.006241
H 4.828507 -0.839271 1.234591
H 4.828397 0.947083 1.315469
H 6.235365 0.993838 -0.823403
H 6.279036 -0.778933 -0.804334
H -3.054519 -2.311895 -1.099741
H -4.565721 1.746376 1.417564
H -5.329041 -2.278853 -0.044781
H -6.087700 -0.236687 1.221471
H 7.590069 -0.699189 1.235289
H 7.480551 0.993343 1.296210
H -2.488506 2.668522 0.827134


