%chk=000082657.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082657

0 1
 O    1.088200       2.998800      0.6232000    
 N   2.5500000E-02   1.079000     -0.1436000    
 C   0.5448000      0.1875000      0.8857000    
 C  -0.8561000      0.4532000      -1.125700    
 C    1.848300     -0.4443000      0.4751000    
 C   -2.074600     -0.1517000     -0.4806000    
 C   0.3481000       2.435900     -0.1878000    
 C    1.836900      -1.653300     -0.2065000    
 C   -2.672600      -1.263300      -1.057700    
 C    3.043000      0.1914000      0.7834000    
 C   -2.582600      0.4105000      0.6822000    
 C  -0.2612000       3.239800      -1.309000    
 C    3.044300      -2.238600     -0.5871000    
 C   -3.801400      -1.824000     -0.4600000    
 C    4.250500     -0.3940000      0.4026000    
 C   -3.711400     -0.1503000       1.280000    
 C    4.251100      -1.609000     -0.2827000    
 C   -4.320700      -1.267500      0.7087000    
 H  -0.1682000     -0.5948000       1.163500    
 H   0.7062000      0.7732000       1.800000    
 H  -0.2721000     -0.3206000      -1.636600    
 H   -1.197500       1.140700      -1.900900    
 H   0.9040000      -2.156500     -0.4441000    
 H   -2.276300      -1.703000      -1.968600    
 H    3.057300       1.135700       1.319500    
 H   -2.150500       1.295300       1.139900    
 H   6.2799998E-02   4.281800      -1.220000    
 H   8.1100002E-02   2.866300      -2.277700    
 H   -1.352300       3.224300      -1.243900    
 H    3.045000      -3.185300      -1.119300    
 H   -4.276300      -2.693500     -0.9050000    
 H    5.190300      9.5600002E-02  0.6404000    
 H   -4.119700      0.2863000       2.186800    
 H    5.191300      -2.065100     -0.5786000    
 H   -5.200400      -1.703100       1.173300    


%chk=000082657-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000082657

0 1
O 1.013843 3.075964 1.012038
N 0.081214 1.164096 0.069604
C 0.746594 0.308956 1.089575
C -0.680907 0.460177 -0.975686
C 1.947636 -0.447020 0.530750
C -1.996090 -0.154470 -0.484793
C 0.270189 2.545190 0.125449
C 1.917849 -1.855564 0.380480
C -2.485524 -1.343715 -1.079896
C 3.116597 0.261936 0.147136
C -2.761679 0.468765 0.531751
C -0.446039 3.406489 -0.916462
C 3.034654 -2.548839 -0.143297
C -3.724381 -1.893109 -0.678737
C 4.231510 -0.427604 -0.376141
C -3.998626 -0.080283 0.937512
C 4.193889 -1.835666 -0.523741
C -4.486432 -1.261295 0.331184
H -0.003094 -0.399808 1.487709
H 1.059666 0.990284 1.899449
H -0.040605 -0.337450 -1.402115
H -0.890216 1.162976 -1.800158
H 1.020144 -2.411589 0.680781
H -1.894549 -1.842668 -1.858854
H 3.143485 1.350972 0.271950
H -2.378982 1.375507 1.015291
H -0.322654 4.456427 -0.612796
H 0.003679 3.282115 -1.919257
H -1.524129 3.178380 -0.992489
H 3.000797 -3.638929 -0.251854
H -4.090736 -2.813431 -1.147521
H 5.131612 0.128114 -0.662852
H -4.579750 0.410393 1.726505
H 5.061145 -2.370182 -0.927735
H -5.445311 -1.687719 0.646119


