%chk=000125114.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125114

0 1
 O   -3.443000       1.279800     -0.3200000    
 N    3.353600      0.4832000      0.1760000    
 N   -1.252900      0.6434000     -0.4252000    
 N    3.017100       1.783800      0.1720000    
 N   -2.932700     -0.7930000      0.4887000    
 C    1.179900      0.4491000     -0.1113000    
 C    2.296500     -0.3705000      1.0200000E-02
 C  -8.4899999E-02 -0.1339000     -0.2958000    
 C    2.227500      -1.764300     -4.2500000E-02
 C    1.694100       1.759100     -2.7999999E-03
 C  -0.1763000      -1.530300     -0.3514000    
 C   -2.521100      0.3090000     -5.7500001E-02
 C   -4.698700      0.6629000     -8.5100003E-02
 C   -4.361100     -0.5641000      0.7247000    
 C   0.9615000      -2.329800     -0.2267000    
 C    4.740500      0.1157000      0.3467000    
 H   -1.077300       1.629100     -0.5986000    
 H    3.110200      -2.387100      5.1600002E-02
 H    1.159300       2.697600     -4.3699998E-02
 H   -1.117400      -2.038700     -0.5371000    
 H   -5.153000      0.4093000      -1.048700    
 H   -5.363900       1.344300      0.4530000    
 H   -4.528500     -0.3921000       1.793700    
 H   -4.962500      -1.425700      0.4199000    
 H   0.8649000      -3.411300     -0.2837000    
 H    5.347700       1.017200      0.4632000    
 H    4.824500     -0.5062000       1.241300    
 H    5.061700     -0.4364000     -0.5400000    


%chk=000125114-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125114

0 1
O -3.420944 1.408368 -0.033460
N 3.454320 0.476822 -0.008535
N -1.230193 0.649310 0.008669
N 3.047897 1.813799 -0.092308
N -3.096705 -0.913955 0.118999
C 1.195768 0.428497 0.007973
C 2.370721 -0.394051 0.053878
C -0.093050 -0.189630 0.055898
C 2.313925 -1.807185 0.145683
C 1.687670 1.778141 -0.081910
C -0.164069 -1.595906 0.147875
C -2.556469 0.274317 0.038198
C -4.804826 0.837964 0.001087
C -4.579575 -0.713263 0.113181
C 1.028800 -2.376379 0.190659
C 4.875775 0.148555 0.004459
H -1.075421 1.656002 -0.054231
H 3.215911 -2.425051 0.179476
H 1.145643 2.721737 -0.139316
H -1.145705 -2.074131 0.186325
H -5.310471 1.142216 -0.929945
H -5.319663 1.272883 0.873118
H -5.011579 -1.126317 1.042243
H -5.023472 -1.256517 -0.739982
H 0.929141 -3.465452 0.261699
H 5.434159 1.093748 -0.058893
H 5.154018 -0.374914 0.937419
H 5.144092 -0.489506 -0.857356


