%chk=000118904.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118904

0 1
 O   -4.268800      -2.130000      0.3858000    
 N   -2.557600     -3.4100000E-02 -0.3787000    
 N   -2.103900       2.021700      0.5015000    
 C  -0.4774000      0.2713000      0.9918000    
 C   0.7222000      0.5105000      7.9700001E-02
 C   -1.737000      0.7709000      0.3665000    
 C    2.058200     -2.3800001E-02  0.6097000    
 C   -3.599700      0.7666000     -0.9668000    
 C    3.239800      0.2537000     -0.3223000    
 C   -3.397800       2.101900     -0.2387000    
 C   -2.319800      -1.387600     -0.8057000    
 C    4.548600     -0.2729000      0.2713000    
 C    5.735700      3.1700000E-02 -0.6422000    
 C   -2.875600      -2.361300      0.2197000    
 C    7.033000     -0.5186000     -7.1699999E-02
 H  -0.5653000     -0.7917000       1.231600    
 H  -0.3277000      0.7999000       1.940700    
 H   0.8200000       1.588900     -0.1025000    
 H   0.5292000      6.0500000E-02 -0.9024000    
 H    1.970000      -1.105200      0.7717000    
 H    2.255400      0.4283000       1.589600    
 H   -3.442600      0.8862000      -2.044200    
 H   -4.599600      0.3591000     -0.7910000    
 H    3.058000     -0.2175000      -1.295600    
 H    3.322100       1.333500     -0.4952000    
 H   -4.206000       2.281500      0.4787000    
 H   -3.374400       2.937100     -0.9461000    
 H   -2.818700      -1.557800      -1.767700    
 H   -1.253700      -1.575500     -0.9677000    
 H    4.717500      0.1826000       1.254700    
 H    4.470500      -1.356000      0.4260000    
 H    5.832400       1.115100     -0.7785000    
 H    5.565400     -0.4062000      -1.632600    
 H   -2.731200      -3.391900     -0.1192000    
 H   -2.391800      -2.240500       1.193500    
 H    6.980500      -1.605800      4.4900000E-02
 H    7.868600     -0.2887000     -0.7402000    
 H    7.249400     -7.7900000E-02  0.9067000    
 H   -4.588500      -2.773900       1.040600    


%chk=000118904-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000118904

0 1
O -4.407319 -2.257672 -0.123688
N -2.457585 0.056439 -0.518136
N -2.286798 1.974174 0.766863
C -0.449182 0.321260 1.028176
C 0.739618 0.500009 0.043912
C -1.762231 0.801660 0.454525
C 2.082925 0.032175 0.645109
C -3.726985 0.769678 -0.841777
C 3.276332 0.223404 -0.318118
C -3.521920 2.127971 -0.083606
C -2.261083 -1.359098 -0.820917
C 4.622941 -0.253702 0.270931
C 5.815439 -0.056884 -0.692999
C -2.959692 -2.346988 0.134238
C 7.156701 -0.540753 -0.100744
H -0.516263 -0.741988 1.335954
H -0.260914 0.916611 1.937971
H 0.804219 1.570038 -0.233617
H 0.542570 -0.054219 -0.896681
H 2.009111 -1.039307 0.928781
H 2.277227 0.589632 1.584976
H -3.833586 0.899577 -1.935260
H -4.594012 0.192604 -0.472717
H 3.076075 -0.324041 -1.263282
H 3.355414 1.296029 -0.592346
H -4.384765 2.385587 0.555759
H -3.364261 2.969224 -0.785282
H -2.627738 -1.563031 -1.845062
H -1.177947 -1.584186 -0.815326
H 4.824692 0.291430 1.216856
H 4.546576 -1.327801 0.542322
H 5.893188 1.016874 -0.960157
H 5.611043 -0.598012 -1.639605
H -2.587562 -3.374827 -0.073320
H -2.724388 -2.084244 1.187394
H 7.115401 -1.618856 0.145174
H 7.992153 -0.387533 -0.808556
H 7.398658 0.005378 0.830706
H -4.896654 -2.842509 0.507250


