%chk=000063264.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063264

0 1
 O    1.625400      -2.164000      0.7009000    
 N   -4.011900      0.2575000      4.3800000E-02
 N   -1.376800     -0.8613000     -0.3600000    
 N   0.9530000     -0.6092000     -0.9030000    
 N    2.341700       1.284900      -1.384900    
 C   -2.801200       1.034700      0.3356000    
 C   -3.756500      -1.176500      0.2267000    
 C   -1.631900      0.5731000     -0.5409000    
 C   -2.588000      -1.638300     -0.6509000    
 C   -5.125700      0.6974000      0.8816000    
 C  -0.2641000      -1.300700      -1.199600    
 C   -6.371600     -0.1321000      0.5838000    
 C   -5.385500       2.181400      0.6428000    
 C    1.829100      -1.131800      6.8899997E-02
 C    1.277700      0.5743000      -1.566100    
 C    3.061700     -0.3459000      0.3070000    
 C    3.265700      0.8287000     -0.4298000    
 C    4.001700     -0.7725000       1.250900    
 C    4.430000       1.571600     -0.2051000    
 C    5.156400     -2.0700000E-02   1.462400    
 C    5.370700       1.149400      0.7361000    
 H   -2.525300      0.9533000       1.395900    
 H   -2.937200       2.096500      0.1073000    
 H   -4.613000      -1.782400     -8.5299999E-02
 H   -3.545500      -1.410200       1.279000    
 H   -1.842800      0.8108000      -1.592200    
 H  -0.7730000       1.170600     -0.2201000    
 H   -2.403800      -2.700600     -0.4486000    
 H   -2.864400      -1.550500      -1.710600    
 H   -4.887500      0.5664000       1.946300    
 H  -9.8800004E-02  -2.374800      -1.051700    
 H  -0.5018000      -1.155200      -2.261900    
 H   -7.253100      0.3211000       1.052600    
 H   -6.574200     -0.1922000     -0.4917000    
 H   -6.306700      -1.146900      0.9893000    
 H   -4.626000       2.821300       1.103100    
 H   -6.338900       2.479600       1.095100    
 H   -5.449100       2.419000     -0.4255000    
 H   0.5346000      0.8864000      -2.316600    
 H    3.852700      -1.681500       1.826900    
 H    4.611900       2.486700     -0.7636000    
 H    5.889900     -0.3469000       2.194000    
 H    6.271000       1.734000      0.9022000    


%chk=000063264-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000063264

0 1
O 0.982800 -2.102120 0.249501
N -3.943070 0.240281 0.082333
N -1.400786 -0.446081 -1.128809
N 1.051022 -0.372279 -1.335269
N 2.784390 1.311280 -1.380572
C -3.020833 1.289503 -0.432086
C -3.131408 -0.910080 0.574511
C -2.145065 0.743056 -1.573503
C -2.261404 -1.495263 -0.550301
C -4.898012 0.765265 1.117614
C -0.258138 -0.859264 -1.908579
C -5.857602 -0.348325 1.599531
C -5.731865 1.942089 0.557456
C 1.568664 -1.069684 -0.199304
C 1.681928 0.756396 -1.853107
C 2.803320 -0.478915 0.351064
C 3.366645 0.695231 -0.251879
C 3.429948 -1.069686 1.479627
C 4.551910 1.257884 0.298022
C 4.600285 -0.503522 2.010170
C 5.159618 0.664168 1.416185
H -2.351773 1.676662 0.379302
H -3.608569 2.134308 -0.826491
H -3.803955 -1.705559 0.934045
H -2.465578 -0.603644 1.420901
H -2.802712 0.512266 -2.447632
H -1.430991 1.531542 -1.879015
H -1.611282 -2.285269 -0.135740
H -2.936563 -1.943370 -1.319058
H -4.323026 1.138876 2.007363
H -0.188100 -1.959585 -1.930520
H -0.285767 -0.476048 -2.950331
H -6.642900 0.088906 2.241750
H -6.343987 -0.827966 0.730252
H -5.349706 -1.128020 2.192261
H -5.130296 2.848464 0.371722
H -6.519016 2.217238 1.281883
H -6.217662 1.641976 -0.389243
H 1.203298 1.201674 -2.733235
H 2.974227 -1.965573 1.914050
H 4.963806 2.153327 -0.176935
H 5.084672 -0.957635 2.881032
H 6.072432 1.101995 1.835134


