%chk=000062485.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062485

0 1
 O    1.112300      -2.946900      -1.037600    
 N    1.594900     -0.4091000      6.0800001E-02
 N    1.812600      0.8030000      0.5879000    
 N    2.630600      -1.081200     -0.4589000    
 C   -3.152000     -1.5000000E-03   1.198600    
 C   -3.562700       1.598800     -0.9993000    
 C   -3.340300       1.412300      0.5379000    
 C   -1.982100     -0.8006000      0.5897000    
 C   -2.790900      0.2422000       2.692800    
 C   -4.489300     -0.7717000       1.216200    
 C   -3.604800       3.123000      -1.271400    
 C   -4.919800       1.029100      -1.456200    
 C   -2.448000       1.002500      -1.867100    
 C  -0.7340000     -0.2355000      0.6069000    
 C   -2.249300      -2.036300      6.1200000E-02
 C   0.3238000     -0.9587000      5.5599999E-02
 C   -1.191500      -2.759300     -0.4900000    
 C   9.5100001E-02  -2.220600     -0.4928000    
 C    3.133200      0.9666000      0.4052000    
 C    3.654700     -0.2347000     -0.2624000    
 C    3.960600       2.050800      0.7521000    
 C    5.014500     -0.3762000     -0.5968000    
 C    5.314100       1.882500      0.4063000    
 C    5.818200      0.7216000     -0.2387000    
 H   -4.175800       1.907500       1.055800    
 H   -2.462300       2.021300      0.7994000    
 H   -1.911500      0.8824000       2.822300    
 H   -2.589200     -0.7021000       3.213500    
 H   -3.617700      0.7364000       3.217400    
 H   -4.428000      -1.669300       1.844900    
 H   -5.288800     -0.1505000       1.638300    
 H   -4.825800      -1.091900      0.2296000    
 H   -2.659600       3.600300     -0.9886000    
 H   -4.407400       3.605000     -0.7014000    
 H   -3.777200       3.337900      -2.332400    
 H   -5.724100       1.303500     -0.7653000    
 H   -5.193200       1.411700      -2.447100    
 H   -4.892300     -5.9099998E-02  -1.550200    
 H   -2.562000       1.324800      -2.910000    
 H   -1.459800       1.342400      -1.543500    
 H   -2.474600     -8.7800004E-02  -1.894400    
 H  -0.5793000      0.7505000       1.030700    
 H   -3.225000      -2.503400      3.7799999E-02
 H   -1.383900      -3.741400     -0.9138000    
 H   0.7602000      -3.792000      -1.365500    
 H    3.596800       2.944100       1.243700    
 H    5.418600      -1.252100      -1.088300    
 H    6.013300       2.682900      0.6450000    
 H    6.882400      0.6812000     -0.4673000    


%chk=000062485-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000062485

0 1
O 1.287107 -3.105298 -1.183037
N 1.688595 -0.513888 -0.029114
N 1.786714 0.859363 -0.211065
N 2.858223 -1.198941 0.227045
C -3.164907 -0.139545 1.122743
C -3.659408 1.707359 -0.878803
C -3.214703 1.338058 0.582487
C -2.006526 -0.954069 0.495881
C -2.874645 -0.033752 2.658029
C -4.529539 -0.857797 0.967130
C -3.160441 3.161929 -1.129115
C -5.207426 1.712653 -1.032615
C -3.037889 0.788942 -1.963099
C -0.692200 -0.428777 0.486317
C -2.178947 -2.259083 -0.030212
C 0.402595 -1.146015 -0.040732
C -1.096263 -2.986457 -0.565042
C 0.207020 -2.439635 -0.596779
C 3.145349 1.074613 -0.072866
C 3.803183 -0.188523 0.191918
C 3.890337 2.285183 -0.161828
C 5.213312 -0.259211 0.377165
C 5.274935 2.196297 0.021598
C 5.928463 0.940337 0.288950
H -3.878875 1.901929 1.271829
H -2.204550 1.769970 0.731669
H -1.939435 0.520934 2.855087
H -2.773352 -1.038927 3.106782
H -3.700293 0.495343 3.170399
H -4.544980 -1.806741 1.535920
H -5.335879 -0.218008 1.367808
H -4.772220 -1.086568 -0.085152
H -2.055557 3.211548 -1.103732
H -3.551463 3.856659 -0.360728
H -3.495745 3.527171 -2.118370
H -5.678642 2.363735 -0.271244
H -5.486759 2.103928 -2.029725
H -5.645018 0.705129 -0.936880
H -3.322529 1.152469 -2.969324
H -1.934810 0.779997 -1.902980
H -3.386472 -0.255095 -1.871269
H -0.479402 0.567990 0.882660
H -3.168364 -2.724338 -0.037120
H -1.266461 -3.988807 -0.980157
H 0.989633 -3.968948 -1.565503
H 3.394105 3.238296 -0.366238
H 5.706043 -1.214939 0.577192
H 5.886161 3.103590 -0.039328
H 7.015624 0.932341 0.424050


