%chk=000178034.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178034

0 1
 O   -1.310200      -2.820600     -0.1537000    
 N  -0.4971000       1.194800     -0.1745000    
 N    1.438600      -1.734700     -6.8800002E-02
 C   0.5340000      0.2952000     -0.1038000    
 C   0.2543000      -1.055700     -9.1499999E-02
 C    1.952200      0.4480000     -2.9000000E-03
 C   -1.856600      0.7753000     -3.6200002E-02
 C    2.488900     -0.8474000      9.9999997E-05
 C   -2.168700     -0.6130000     -1.1300000E-02
 C   -1.068700      -1.621500     -9.9200003E-02
 C  -0.2542000       2.609800     -0.4430000    
 C    2.856400       1.528600      0.1093000    
 C    3.863700      -1.105200      7.5700000E-02
 C   -2.931200       1.672400      9.8399997E-02
 C   -3.488500      -1.066200      0.1079000    
 C    4.233500       1.284700      0.1875000    
 C    4.728500     -1.4200000E-02  0.1656000    
 C   -4.248500       1.216700      0.2206000    
 C   -4.526400     -0.1467000      0.2198000    
 H    1.532700      -2.741100     -6.5499999E-02
 H   -1.010700       3.039200      -1.110100    
 H   0.6849000       2.771200     -0.9791000    
 H  -0.2309000       3.181700      0.4905000    
 H    2.510200       2.556400      0.1511000    
 H    4.247700      -2.120200      7.1999997E-02
 H   -2.775400       2.747500      0.1260000    
 H   -3.723700      -2.126800      0.1226000    
 H    4.921200       2.122200      0.2710000    
 H    5.800200     -0.1835000      0.2283000    
 H   -5.059100       1.933300      0.3209000    
 H   -5.551400     -0.4924000      0.3156000    


%chk=000178034-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178034

0 1
O -1.280812 -2.933244 -0.021690
N -0.535338 1.239698 -0.100118
N 1.440598 -1.777593 -0.010250
C 0.510958 0.313457 -0.051540
C 0.236748 -1.072471 -0.034978
C 1.958904 0.470113 -0.009954
C -1.866037 0.773793 -0.010270
C 2.499762 -0.876855 0.003816
C -2.153653 -0.639426 0.014610
C -1.080381 -1.662350 -0.021968
C -0.254067 2.670403 -0.317648
C 2.872213 1.560951 0.057272
C 3.889254 -1.131277 0.044490
C -2.955824 1.694557 0.058590
C -3.505200 -1.073898 0.081787
C 4.254456 1.305715 0.102582
C 4.759913 -0.027628 0.087811
C -4.279047 1.232173 0.127000
C -4.565766 -0.160079 0.132095
H 1.477274 -2.795726 0.009063
H -1.015232 3.106830 -0.984172
H 0.717689 2.773836 -0.818337
H -0.238914 3.239649 0.631199
H 2.526036 2.597693 0.096999
H 4.275181 -2.156119 0.048334
H -2.772424 2.771762 0.087093
H -3.670928 -2.156832 0.093842
H 4.956278 2.144556 0.156956
H 5.842164 -0.193551 0.120844
H -5.096475 1.959594 0.186032
H -5.601629 -0.509932 0.183812


