%chk=000145540.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145540

0 1
 O   -5.481200       1.803000      7.4500002E-02
 O    6.646600     -0.2995000     -0.5358000    
 O    6.496200     -0.2845000       1.800200    
 N   0.6418000      0.2072000      0.3618000    
 N    1.123100      0.1674000     -0.7949000    
 C   -7.313200     -0.2840000      7.4999998E-03
 C   -5.814200     -0.5843000      6.4300001E-02
 C   -8.138200      -1.570400      8.8000000E-03
 C   -4.974500      0.6837000      0.1017000    
 C   -3.488800      0.5578000      0.1720000    
 C   -9.629500      -1.276000     -9.4999997E-03
 C   -2.935100     -0.7016000      0.2003000    
 C   -2.730600       1.705600      0.2034000    
 C   -1.546700     -0.8196000      0.2638000    
 C   -1.342100       1.587700      0.2668000    
 C  -0.7502000      0.3251000      0.2969000    
 C    2.522000      4.9100000E-02 -0.7294000    
 C    3.107400      -1.212600     -0.6979000    
 C    3.311100       1.194700     -0.6968000    
 C    5.291900     -0.1851000     -0.6003000    
 C    4.495800      -1.330100     -0.6332000    
 C    4.699500       1.077300     -0.6322000    
 C    7.157300     -0.3424000      0.7720000    
 C    8.651600     -0.4685000      0.7360000    
 H   -7.540000      0.3010000     -0.8926000    
 H   -7.597400      0.3361000      0.8671000    
 H   -5.607600      -1.167500      0.9688000    
 H   -5.537000      -1.165100     -0.8225000    
 H   -7.879500      -2.179200     -0.8653000    
 H   -7.901800      -2.164200      0.8995000    
 H   -10.20030      -2.209900     -9.7000003E-03
 H   -9.906300     -0.7084000     -0.9036000    
 H   -9.926200     -0.6970000      0.8708000    
 H   -3.513900      -1.617500      0.1756000    
 H   -3.171000       2.697500      0.1807000    
 H   -1.094100      -1.807600      0.2877000    
 H  -0.7298000       2.485500      0.2932000    
 H    2.494800      -2.109700     -0.7241000    
 H    2.857700       2.182100     -0.7220000    
 H    4.950900      -2.316500     -0.6092000    
 H    5.313800       1.973300     -0.6073000    
 H    9.082900      0.3995000      0.2316000    
 H    9.037300     -0.5067000       1.758700    
 H    8.931600      -1.391500      0.2225000    


%chk=000145540-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000145540

0 1
O -5.835081 1.891850 -0.157021
O 6.834433 0.040327 0.047659
O 7.510493 -2.204779 0.321815
N 0.534970 0.870671 -0.048382
N 1.183733 -0.262826 0.065345
C -7.548350 -0.342549 -0.035139
C -6.021062 -0.536402 -0.018602
C -8.316398 -1.682173 0.009043
C -5.236396 0.777365 -0.086321
C -3.731487 0.728294 -0.070374
C -9.847852 -1.486847 -0.004450
C -3.002131 -0.493350 0.018312
C -3.015098 1.954070 -0.148272
C -1.598594 -0.495582 0.030811
C -1.610992 1.960863 -0.138928
C -0.890848 0.738483 -0.047895
C 2.605951 -0.134139 0.057691
C 3.328580 -1.347023 0.198010
C 3.315902 1.095772 -0.079957
C 5.421801 -0.132403 0.066226
C 4.737933 -1.365174 0.205587
C 4.715941 1.091566 -0.075823
C 7.792019 -1.000631 0.175237
C 9.174107 -0.394720 0.103280
H -7.834264 0.226737 -0.940223
H -7.845655 0.291210 0.822332
H -5.714629 -1.086441 0.896233
H -5.707675 -1.178679 -0.868941
H -8.016814 -2.309039 -0.856382
H -8.024539 -2.247418 0.918450
H -10.380202 -2.455194 0.026288
H -10.170287 -0.951543 -0.917245
H -10.178467 -0.890531 0.866619
H -3.537044 -1.446808 0.078302
H -3.590823 2.882604 -0.216063
H -1.026467 -1.425362 0.099459
H -1.041388 2.893687 -0.199887
H 2.761187 -2.277429 0.302058
H 2.748398 2.024399 -0.187742
H 5.287903 -2.299305 0.315484
H 5.291062 2.016434 -0.180757
H 9.308434 0.342335 0.913883
H 9.929095 -1.188588 0.192140
H 9.304702 0.142468 -0.851960


