%chk=000094440.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094440

0 1
 O    2.781000       1.590600     -0.5501000    
 N    1.911000     -0.5650000     -0.3758000    
 N    4.164200     -9.8099999E-02  0.2205000    
 C   -3.697200      0.1413000      0.1445000    
 C   -2.178100     -5.0000001E-02  3.1000001E-03
 C   -4.227800     -0.7450000       1.292200    
 C   -4.396500     -0.2608000      -1.172200    
 C   -4.117800       1.594900      0.4587000    
 C   -1.703200      -1.306500     -0.2772000    
 C   -1.366200       1.044700      0.1643000    
 C   0.5326000     -0.3912000     -0.2480000    
 C  -0.3251000      -1.480100     -0.4048000    
 C   1.2000000E-02  0.8713000      3.6699999E-02
 C    2.929600      0.4031000     -0.2537000    
 C    5.333900      0.7550000      0.3880000    
 C    4.347900      -1.504200      0.5738000    
 H   -5.303500     -0.5943000       1.441900    
 H   -4.080900      -1.813100       1.097900    
 H   -3.724300     -0.5099000       2.237500    
 H   -4.253400      -1.319200      -1.415600    
 H   -5.478200     -9.2299998E-02  -1.111700    
 H   -4.015300      0.3258000      -2.016600    
 H   -3.818700       2.289600     -0.3350000    
 H   -5.208700       1.673300      0.5475000    
 H   -3.701600       1.946200       1.410400    
 H   -2.350800      -2.167400     -0.4032000    
 H   -1.715900       2.043700      0.3910000    
 H   6.6900000E-02  -2.469500     -0.6267000    
 H   0.6297000       1.747300      0.1933000    
 H    2.206200      -1.525100     -0.5282000    
 H    6.153200      0.3520000     -0.2144000    
 H    5.617900      0.7611000       1.444200    
 H    5.125800       1.779400      6.9499999E-02
 H    4.475000      -2.079600     -0.3476000    
 H    3.482400      -1.879300       1.127000    
 H    5.235500      -1.622800       1.202400    


%chk=000094440-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000094440

0 1
O 2.815215 1.630886 0.339206
N 1.968252 -0.557338 0.101032
N 4.296541 -0.180023 0.204094
C -3.833552 0.160733 0.068208
C -2.292839 0.022386 0.082620
C -4.439465 -0.653327 1.251555
C -4.393316 -0.396792 -1.275759
C -4.291628 1.635071 0.209063
C -1.692236 -1.260299 -0.046222
C -1.414314 1.125769 0.220142
C 0.567247 -0.304507 0.101067
C -0.296210 -1.426363 -0.038014
C -0.008836 0.983909 0.231215
C 3.008772 0.379375 0.222226
C 5.449976 0.726705 0.311799
C 4.553062 -1.621943 0.087335
H -5.543222 -0.571219 1.248902
H -4.179103 -1.725096 1.184233
H -4.065065 -0.274681 2.220309
H -4.125316 -1.459051 -1.420064
H -5.497112 -0.319904 -1.292656
H -3.991938 0.172610 -2.134079
H -3.911881 2.261409 -0.619200
H -5.396021 1.684940 0.188672
H -3.953699 2.078361 1.163942
H -2.322064 -2.151096 -0.156002
H -1.820805 2.136577 0.322201
H 0.129660 -2.434166 -0.140369
H 0.646668 1.849857 0.337393
H 2.221683 -1.540251 -0.003341
H 6.095443 0.659124 -0.585433
H 6.057193 0.492489 1.207590
H 5.065619 1.754273 0.398897
H 4.192484 -2.040014 -0.875866
H 4.102254 -2.197956 0.921997
H 5.640156 -1.794552 0.126907


