%chk=000148080.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148080

0 1
 O    10.23360     -0.7422000     -0.5297000    
 N   -6.760800     -0.3205000     -9.7999997E-02
 N   -9.460500      0.3337000     -0.7639000    
 N   -4.488800      0.4246000     -0.1165000    
 N   -1.435400      -1.047700      0.7072000    
 N   -2.116600      0.9350000     -4.4700000E-02
 N    3.833100     -0.4357000     -9.1799997E-02
 N    4.312800       1.707700      0.2476000    
 C   -7.499800      -1.143200      -1.060500    
 C   -7.247200       1.055100      6.7299999E-02
 C   -9.004800      -1.061400     -0.7935000    
 C   -8.759800       1.065300      0.2989000    
 C   -5.402600     -0.5695000      0.1293000    
 C   -10.90740      0.3966000     -0.5618000    
 C   -5.042800      -1.845400      0.6053000    
 C   -2.796000      -1.143300      0.5981000    
 C   -3.194100      0.1033000      0.1286000    
 C   -3.709300      -2.160500      0.8523000    
 C   -1.076600      0.2128000      0.3113000    
 C   0.2995000      0.6471000      0.3052000    
 C    2.624000      0.1860000      8.7200001E-02
 C    1.313100     -0.2917000      8.3400004E-02
 C    2.950200       1.523000      0.2973000    
 C   0.5962000       1.995700      0.5189000    
 C    1.920100       2.452600      0.5184000    
 C    4.810500      0.5143000      1.3000000E-02
 C    6.209500      0.1899000     -0.1274000    
 C    7.097600       1.139000     -0.6324000    
 C    6.672900      -1.072500      0.2425000    
 C    8.450000      0.8257000     -0.7679000    
 C    8.025300      -1.386000      0.1070000    
 C    8.914000     -0.4368000     -0.3981000    
 C    10.64020      -2.050900     -0.1327000    
 H   -7.200000      -2.196100      -1.009500    
 H   -7.277400     -0.7943000      -2.077300    
 H   -6.996600       1.643800     -0.8245000    
 H   -6.765100       1.533000      0.9294000    
 H   -9.523900      -1.608300      -1.590000    
 H   -9.237000      -1.565900      0.1542000    
 H   -8.983600      0.6291000       1.282000    
 H   -9.096000       2.109000      0.3210000    
 H   -11.21470     -5.5799998E-02  0.3881000    
 H   -11.43150     -0.1185000      -1.374500    
 H   -11.25240       1.436500     -0.5759000    
 H   -5.800200      -2.600200      0.8033000    
 H   -3.406900      -3.132500       1.221800    
 H  -0.8190000      -1.779100       1.036400    
 H    1.116400      -1.342800     -9.8800004E-02
 H  -0.1970000       2.720200      0.6938000    
 H    3.962400      -1.420900     -0.2815000    
 H    2.140000       3.502100      0.6861000    
 H    6.756600       2.127900     -0.9294000    
 H    6.008800      -1.829700      0.6519000    
 H    9.137500       1.568800      -1.162600    
 H    8.318800      -2.383500      0.4159000    
 H    10.16690      -2.823500     -0.7482000    
 H    10.47720      -2.215500      0.9379000    
 H    11.71910      -2.120800     -0.3060000    


%chk=000148080-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000148080

0 1
O 10.502987 -0.169448 0.307000
N -6.939196 -0.428628 -0.454129
N -9.603845 0.593708 -0.056255
N -4.657075 0.136006 -0.431710
N -1.543305 -1.573580 -0.171981
N -2.241679 0.597578 -0.358165
N 3.888286 -0.677449 0.014928
N 4.232128 1.574437 -0.138227
C -8.096861 -1.334285 -0.509061
C -7.262499 0.975590 -0.787148
C -9.254678 -0.784674 0.351614
C -8.424189 1.484502 0.080409
C -5.606402 -0.852417 -0.398240
C -10.786980 1.108392 0.659035
C -5.252976 -2.252199 -0.301278
C -2.940452 -1.622214 -0.230651
C -3.360204 -0.250872 -0.346832
C -3.905441 -2.646499 -0.212480
C -1.163831 -0.219415 -0.251174
C 0.228289 0.241371 -0.222404
C 2.611789 -0.107656 -0.087442
C 1.320476 -0.661037 -0.105029
C 2.854007 1.308414 -0.182753
C 0.462141 1.654278 -0.317753
C 1.755987 2.194652 -0.299571
C 4.834125 0.367264 -0.018946
C 6.281506 0.159213 0.067415
C 7.140358 1.297247 0.023104
C 6.871244 -1.124866 0.195389
C 8.530533 1.153299 0.104564
C 8.270736 -1.284149 0.278360
C 9.105689 -0.139313 0.233195
C 11.150645 -1.477512 0.441902
H -7.829017 -2.332394 -0.128589
H -8.451833 -1.444313 -1.557267
H -7.557183 1.043971 -1.856588
H -6.352229 1.574146 -0.632775
H -10.141658 -1.432480 0.216500
H -8.952790 -0.831828 1.430990
H -8.084840 1.553006 1.145882
H -8.707644 2.500019 -0.253592
H -10.638689 1.183465 1.766594
H -11.652652 0.446852 0.474066
H -11.038892 2.115091 0.280221
H -6.023191 -3.025614 -0.309607
H -3.643353 -3.707496 -0.142069
H -0.916397 -2.370545 -0.089773
H 1.171641 -1.744724 -0.029801
H -0.418476 2.296926 -0.405959
H 4.097156 -1.669341 0.099217
H 1.924429 3.272744 -0.372650
H 6.680873 2.285160 -0.075817
H 6.250465 -2.028869 0.233734
H 9.196147 2.020834 0.071585
H 8.692284 -2.288674 0.376686
H 10.932320 -2.125228 -0.429238
H 10.836866 -1.986605 1.373795
H 12.227852 -1.260744 0.482268


