%chk=000150455.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150455

0 1
 O   -1.626600       1.342400      -2.164100    
 O   -3.139500      -3.935400      0.9465000    
 O   -4.211300      -1.934400      0.9662000    
 N   -2.126800       2.211700       1.068100    
 N  -0.8015000       3.349100     -0.6136000    
 N    5.393900      -2.361900      0.1636000    
 C   0.2991000       1.601200      0.7481000    
 C   -1.044300       2.075800      7.8299999E-02
 C    1.466100       1.331200     -0.2397000    
 C    2.764100      0.8020000      0.3514000    
 C   0.7806000       2.500400       1.903300    
 C   -1.457700       1.028000     -0.9822000    
 C   -1.713300     -0.4065000     -0.5188000    
 C    3.811800      0.6813000     -0.7266000    
 C    2.510700     -0.4950000       1.077900    
 C    4.145900      -1.776100     -0.3330000    
 C   -2.730200      -1.129800      -1.405800    
 C    4.423900     -0.4714000      -1.035800    
 C    3.123500      -1.647100      0.7677000    
 C   -3.443600       2.570600      0.5521000    
 C   -2.926600      -2.589500     -0.9977000    
 C   -3.498100      -2.746800      0.3942000    
 H   5.9300002E-02  0.6404000       1.222600    
 H    1.685600       2.270100     -0.7672000    
 H    1.123200      0.6348000      -1.016600    
 H    3.164800       1.518900       1.077600    
 H    1.152100       3.460300       1.529900    
 H    1.583200       2.028600       2.477400    
 H  -1.4100000E-02   2.702400       2.626200    
 H   -1.861500       2.906700       1.763700    
 H  -0.6186000       4.078600      7.3500000E-02
 H   -1.636100       3.636900      -1.121100    
 H   -2.071900     -0.3879000      0.5139000    
 H  -0.7549000     -0.9366000     -0.5351000    
 H    4.077100       1.579900      -1.277900    
 H    1.819100     -0.4985000       1.915200    
 H    3.732100      -2.465800      -1.079700    
 H   -2.395300      -1.104700      -2.450000    
 H   -3.688300     -0.5965000      -1.371400    
 H    5.156600     -0.4731000      -1.839200    
 H    2.880600      -2.538600       1.341000    
 H   -3.452700       3.566100      9.8700002E-02
 H   -4.155300       2.587500       1.384100    
 H   -3.820100       1.841100     -0.1703000    
 H   -3.612300      -3.082400      -1.695100    
 H   -1.961400      -3.107200      -1.044300    
 H    5.203000      -3.283000      0.5580000    
 H    6.026100      -2.529400     -0.6192000    
 H   -3.514700      -4.048300       1.845800    


%chk=000150455-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150455

0 1
O -1.642685 1.369226 -2.082289
O -3.759011 -4.103333 0.652916
O -4.478580 -1.907093 0.454206
N -2.093397 2.145344 1.227524
N -0.842655 3.393522 -0.558550
N 5.309535 -2.492862 -0.043844
C 0.316546 1.682030 0.866806
C -1.034196 2.137475 0.176444
C 1.376942 1.349870 -0.215877
C 2.757867 0.838863 0.317586
C 0.838986 2.769998 1.835114
C -1.478200 1.055513 -0.872429
C -1.748375 -0.350884 -0.359668
C 3.710825 0.631549 -0.844722
C 2.629598 -0.413438 1.166095
C 4.014243 -1.849737 -0.407579
C -2.329621 -1.286364 -1.435733
C 4.272139 -0.559542 -1.166349
C 3.191871 -1.605938 0.846938
C -3.435018 2.610085 0.824836
C -2.567833 -2.716421 -0.915325
C -3.685270 -2.809786 0.107782
H 0.077255 0.771740 1.451003
H 1.531773 2.263727 -0.823020
H 0.988101 0.576578 -0.907557
H 3.179150 1.646867 0.956407
H 1.111390 3.681226 1.272161
H 1.737773 2.418942 2.372039
H 0.103030 3.047406 2.613729
H -1.764362 2.574299 2.099343
H -0.951458 4.253435 -0.021709
H -1.225010 3.397643 -1.508659
H -2.420384 -0.255004 0.514089
H -0.798445 -0.763435 0.041587
H 3.928479 1.518417 -1.456917
H 2.053827 -0.324879 2.098069
H 3.409624 -2.515199 -1.082077
H -1.642978 -1.325794 -2.300925
H -3.278486 -0.863666 -1.811851
H 4.946682 -0.630388 -2.032582
H 3.063326 -2.468032 1.518206
H -3.447990 3.618362 0.352078
H -4.089961 2.630134 1.713199
H -3.884771 1.900857 0.104841
H -2.836822 -3.395798 -1.748266
H -1.652999 -3.146114 -0.463623
H 5.197285 -3.387365 0.447274
H 5.959743 -2.572464 -0.834184
H -4.511780 -4.139475 1.304061


