%chk=000080058.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080058

1 1
 O    3.267300      0.7760000     -8.2000000E-03
 N  -0.3642000     -8.2999997E-02  1.9999999E-04
 C   0.9676000      0.3928000      0.5626000    
 C  -0.2064000      -1.491100     -0.5554000    
 C   -1.409000     -8.8299997E-02   1.106700    
 C  -0.8090000      0.8546000      -1.113000    
 C    2.012400      0.3670000     -0.5356000    
 C   0.2358000      -2.418300      0.5556000    
 C   -1.561400       1.313800       1.654900    
 C   -2.133100      0.3765000      -1.667800    
 H   0.8668000       1.435500      0.8800000    
 H    1.248400     -0.1815000       1.450300    
 H   -1.186500      -1.849200     -0.8832000    
 H   0.4549000      -1.496400      -1.425000    
 H   -2.346500     -0.5236000      0.7528000    
 H   -1.043300     -0.7065000       1.931500    
 H  -0.8301000       1.889200     -0.7625000    
 H  -8.7700002E-02  0.7940000      -1.932700    
 H    2.193200     -0.6281000     -0.9425000    
 H    1.803600       1.050200      -1.360500    
 H   0.3591000      -3.420400      0.1244000    
 H    1.208400      -2.173800      0.9871000    
 H  -0.4993000      -2.546900       1.353100    
 H   -2.319800       1.280500       2.448100    
 H  -0.6668000       1.708300       2.141100    
 H   -1.940000       2.040500      0.9334000    
 H   -2.432000       1.073500      -2.461800    
 H   -2.092100     -0.5995000      -2.155900    
 H   -2.956300      0.3966000     -0.9511000    
 H    3.159800       1.676600      0.3423000    


%chk=000080058-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080058

1 1
O 3.218112 0.882276 0.423008
N -0.397407 -0.072569 0.009090
C 0.936622 0.483194 0.534751
C -0.247483 -1.542927 -0.479222
C -1.435464 -0.046871 1.169120
C -0.871187 0.807238 -1.181352
C 2.123957 0.453577 -0.445877
C 0.418041 -2.505562 0.511776
C -1.807375 1.343172 1.698607
C -2.260990 0.478663 -1.738680
H 0.761640 1.525167 0.843593
H 1.213769 -0.095971 1.429832
H -1.267974 -1.884631 -0.717485
H 0.322515 -1.499069 -1.422690
H -2.326592 -0.572057 0.787663
H -0.997993 -0.658459 1.974801
H -0.827679 1.849520 -0.824740
H -0.106680 0.685608 -1.966893
H 2.305911 -0.564094 -0.848675
H 1.977664 1.155283 -1.291683
H 0.433495 -3.505278 0.042646
H 1.463764 -2.241545 0.739214
H -0.137981 -2.609545 1.457975
H -2.550895 1.201829 2.503001
H -0.956543 1.880961 2.147385
H -2.279296 1.986575 0.937606
H -2.455032 1.170885 -2.576981
H -2.335195 -0.542424 -2.147346
H -3.069293 0.631754 -1.004811
H 4.049370 1.024302 -0.094732


