%chk=000089238.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089238

0 1
 O   -3.918800     -0.7636000      0.7193000    
 N  -0.4836000      0.7880000      4.6799999E-02
 C   -3.110000     -0.2913000     -0.3660000    
 C   -4.489000     -0.8564000     -0.5964000    
 C   -1.897600      -1.126200     -0.6455000    
 C   -2.891800       1.190900     -0.3783000    
 C  -0.7153000     -0.6576000      0.2073000    
 C   -1.666600       1.559800      0.4633000    
 C   0.6907000       1.203200      0.8143000    
 C    1.936000      0.4851000      0.3668000    
 C    2.285700     -0.7162000      0.9677000    
 C    2.717200       1.034600     -0.6403000    
 C    3.439600      -1.381300      0.5534000    
 C    3.871100      0.3694000      -1.054700    
 C    4.232400     -0.8385000     -0.4578000    
 H   -5.296600     -0.1778000     -0.8394000    
 H   -4.582100      -1.843100      -1.031600    
 H   -1.645900      -1.039700      -1.710000    
 H   -2.091900      -2.187300     -0.4481000    
 H   -3.769700       1.725700      3.4000000E-03
 H   -2.742200       1.519400      -1.414200    
 H  -0.8951000     -0.9113000       1.260300    
 H   0.1263000      -1.254000     -0.1522000    
 H   -1.477600       2.633000      0.3389000    
 H   -1.884400       1.385800       1.525600    
 H   0.5420000       1.044500       1.891700    
 H   0.8520000       2.283100      0.6945000    
 H    1.688200      -1.143700       1.768100    
 H    2.444400       1.973700      -1.113300    
 H    3.723000      -2.319900       1.020600    
 H    4.488200      0.7917000      -1.842200    
 H    5.131300      -1.355900     -0.7799000    


%chk=000089238-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000089238

0 1
O -4.152945 -0.678359 0.483953
N -0.512592 0.618902 0.259677
C -3.188252 -0.126815 -0.568113
C -4.575147 -0.519048 -0.959112
C -2.001926 -1.031480 -0.867970
C -2.814731 1.335173 -0.368685
C -0.888073 -0.817547 0.178686
C -1.670892 1.457962 0.661269
C 0.667698 0.843096 1.128675
C 1.960860 0.283553 0.542040
C 2.933899 -0.312912 1.380877
C 2.229235 0.394450 -0.846107
C 4.157823 -0.781201 0.848494
C 3.448160 -0.075758 -1.381733
C 4.419420 -0.663200 -0.535660
H -5.329599 0.260220 -1.132203
H -4.739175 -1.463626 -1.494969
H -1.606543 -0.789641 -1.873815
H -2.321088 -2.089544 -0.864052
H -3.694693 1.907410 -0.022714
H -2.479920 1.757759 -1.336114
H -1.242668 -1.196625 1.170827
H 0.009274 -1.396666 -0.100899
H -1.335483 2.509899 0.725164
H -2.061836 1.163491 1.668452
H 0.519112 0.422656 2.156623
H 0.774956 1.940298 1.251681
H 2.732908 -0.414272 2.455131
H 1.462536 0.840408 -1.489739
H 4.900834 -1.240946 1.510354
H 3.642996 0.014440 -2.456827
H 5.365752 -1.027977 -0.951091


