%chk=000071781.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071781

0 1
 O   -3.337400      -1.889500      -1.278000    
 N   0.9235000      -1.013900      1.3500000E-02
 C   -1.965600      -1.034900      0.5111000    
 C   -1.292500      1.2200000E-02 -0.3827000    
 C   -1.115800      -2.309600      0.5452000    
 C   0.1630000      0.2428000      2.8999999E-02
 C   0.3337000      -2.002000      0.9267000    
 C   -3.384000      -1.333600      3.3799998E-02
 C    2.323600     -0.7691000      0.3591000    
 C   -4.248200     -9.5899999E-02  2.0500001E-02
 C    2.986100      0.1565000     -0.6620000    
 C    4.436900      0.3991000     -0.3295000    
 C   -4.973200      0.2386000       1.153400    
 C   -4.300900      0.6839000      -1.124100    
 C   -5.771600       1.382300       1.141300    
 C   -5.099300       1.827600      -1.136100    
 C    4.779000       1.466800      0.4868000    
 C    5.405000     -0.4495000     -0.8450000    
 C   -5.834700       2.176700     -3.3000000E-03
 C    6.120900       1.691200      0.7945000    
 C    6.746800     -0.2250000     -0.5370000    
 C    7.104600      0.8453000      0.2828000    
 H   -2.012600     -0.6296000       1.532000    
 H   -1.798500      0.9801000     -0.3085000    
 H   -1.318300     -0.2960000      -1.435700    
 H   -1.113100      -2.807100     -0.4324000    
 H   -1.538100      -3.021600       1.264200    
 H   0.5495000      0.9661000     -0.6934000    
 H   0.1985000      0.7128000       1.020700    
 H   0.3736000      -1.648000       1.965400    
 H   0.9031000      -2.938300      0.8804000    
 H   -3.854300      -2.086300      0.6796000    
 H    2.867700      -1.722900      0.3687000    
 H    2.411500     -0.3468000       1.369500    
 H    2.906400     -0.2685000      -1.671400    
 H    2.512600       1.141900     -0.7125000    
 H   -3.118300      -2.832800      -1.194700    
 H   -4.928700     -0.3725000       2.050300    
 H   -3.738500      0.4376000      -2.019800    
 H   -6.343500       1.654700       2.023500    
 H   -5.148200       2.446900      -2.027000    
 H    4.020400       2.129800      0.8928000    
 H    5.136100      -1.286900      -1.482600    
 H   -6.456000       3.067500     -1.2600000E-02
 H    6.399600       2.524100       1.433400    
 H    7.513000     -0.8840000     -0.9349000    
 H    8.149400       1.019900      0.5228000    


%chk=000071781-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071781

0 1
O -3.422820 -1.798081 -1.542712
N 0.939994 -0.802206 0.051566
C -1.997514 -0.979490 0.357849
C -1.322616 0.130117 -0.479547
C -1.074775 -2.222400 0.410187
C 0.101089 0.423981 0.033987
C 0.331767 -1.843695 0.915814
C -3.431856 -1.342430 -0.141833
C 2.352106 -0.532563 0.414679
C -4.401705 -0.169920 -0.045664
C 3.149554 0.163595 -0.722442
C 4.612944 0.338327 -0.345682
C -4.841245 0.266962 1.229658
C -4.863960 0.504768 -1.200964
C -5.717995 1.367588 1.350984
C -5.743870 1.604780 -1.080758
C 5.042669 1.471393 0.393270
C 5.573327 -0.651229 -0.680683
C -6.171555 2.043203 0.193515
C 6.392613 1.613913 0.786304
C 6.924832 -0.514126 -0.290502
C 7.339384 0.619740 0.446383
H -2.114002 -0.606655 1.398864
H -1.924563 1.057085 -0.440686
H -1.272454 -0.189205 -1.537497
H -0.957219 -2.657940 -0.604548
H -1.509360 -3.001836 1.068223
H 0.577818 1.174025 -0.621573
H 0.038229 0.873501 1.062038
H 0.253350 -1.498863 1.982283
H 0.989394 -2.732976 0.906311
H -3.803604 -2.168866 0.508044
H 2.839214 -1.502497 0.631506
H 2.434432 0.083294 1.347526
H 3.044999 -0.454532 -1.632786
H 2.698999 1.149719 -0.941467
H -2.763856 -2.531207 -1.631111
H -4.505450 -0.258548 2.133306
H -4.538983 0.146434 -2.181499
H -6.052200 1.692691 2.342908
H -6.098327 2.117224 -1.982610
H 4.314749 2.250375 0.653803
H 5.258847 -1.530305 -1.257490
H -6.854905 2.895159 0.284666
H 6.706857 2.498372 1.352470
H 7.653525 -1.286039 -0.563786
H 8.387340 0.729462 0.747495


