%chk=000149773.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149773

0 1
 O   -5.653000     -0.3081000     -0.4622000    
 O   -1.310500      -2.422700     -0.1879000    
 O    2.274200       1.247500     -6.2399998E-02
 O   0.7721000      -3.350200     -3.9099999E-02
 N    4.993100      0.7831000     -0.1124000    
 N    1.945600     -0.9451000      0.6467000    
 C    4.158300     -2.4499999E-02  0.7654000    
 C   -3.830500      0.9126000      7.9800002E-02
 C    4.786000      0.4079000      -1.513000    
 C    6.406700      0.6435000      0.2449000    
 C   -1.614000     -4.8300002E-02  0.2456000    
 C   -4.306900     -0.3520000     -0.2533000    
 C   -2.149500      -1.289300     -9.3400002E-02
 C   -2.454500       1.072600      0.3357000    
 C   -4.964900       1.767100      6.8200000E-02
 C   0.6028000      -1.025300      0.4107000    
 C   -3.508200      -1.488200     -0.3543000    
 C  -0.1847000      5.2099999E-02  0.5009000    
 C    2.702600      0.1943000      0.4046000    
 C    5.652400       1.244500      -2.439300    
 C    6.658600       1.092300       1.674500    
 C   -6.041600      0.9787000     -0.2655000    
 C   5.9900001E-02  -2.355600      4.8799999E-02
 C   -4.994200       3.213000      0.3567000    
 H    4.422800      -1.087300      0.7049000    
 H    4.231800      0.2884000       1.812400    
 H    5.003800     -0.6552000      -1.679500    
 H    3.752500      0.5726000      -1.832100    
 H    6.764200     -0.3851000      0.1099000    
 H    7.033100       1.295300     -0.3721000    
 H   -2.058100       2.049900      0.5981000    
 H   -3.915500      -2.456700     -0.6169000    
 H   0.1669000       1.027500      0.8157000    
 H    2.432400      -1.824600      0.8003000    
 H    5.588300       2.312400      -2.204000    
 H    6.702200      0.9353000      -2.427900    
 H    5.307100       1.119600      -3.472200    
 H    6.205200       2.068200       1.879300    
 H    6.293400      0.3694000       2.410200    
 H    7.736900       1.191600       1.843600    
 H   -7.096700       1.170200     -0.3975000    
 H   -6.007400       3.619700      0.2723000    
 H   -4.637000       3.409900       1.372800    
 H   -4.354200       3.758300     -0.3444000    


%chk=000149773-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149773

0 1
O -5.885603 -0.399533 0.152917
O -1.471098 -2.468621 0.358344
O 2.411021 1.228160 0.120777
O 0.617146 -3.429466 0.452828
N 5.231553 0.558757 -0.167219
N 1.932287 -1.052614 0.302088
C 4.283912 -0.383023 0.428986
C -3.970564 0.912917 0.078482
C 5.146845 0.612555 -1.651285
C 6.614313 0.396179 0.349989
C -1.715959 -0.016763 0.174291
C -4.481626 -0.421414 0.171656
C -2.296285 -1.328627 0.265038
C -2.576604 1.111738 0.079969
C -5.131824 1.799495 -0.001485
C 0.524651 -1.020444 0.278343
C -3.682711 -1.565112 0.266045
C -0.275028 0.105958 0.181975
C 2.808495 0.036913 0.253525
C 5.664450 1.941406 -2.232684
C 6.779425 0.854206 1.812017
C -6.237973 0.978247 0.046152
C -0.058705 -2.375429 0.368986
C -5.105458 3.299234 -0.113105
H 4.404104 -1.435234 0.047072
H 4.468454 -0.429641 1.519690
H 5.686759 -0.249411 -2.121467
H 4.081516 0.513011 -1.927048
H 6.972511 -0.660943 0.240884
H 7.274038 1.015034 -0.282910
H -2.141700 2.114323 0.010425
H -4.084653 -2.577428 0.336245
H 0.197149 1.088472 0.110419
H 2.320211 -2.002910 0.372016
H 5.106278 2.781897 -1.786866
H 6.740795 2.096549 -2.036562
H 5.521404 1.959327 -3.329129
H 6.423511 1.892739 1.923906
H 6.217823 0.220512 2.522707
H 7.844247 0.809142 2.106458
H -7.306984 1.172260 0.018744
H -6.123624 3.721064 -0.154794
H -4.586253 3.754131 0.751285
H -4.568745 3.621691 -1.025104


