%chk=000135483.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000135483

0 1
 O    2.634400     -0.9417000     -0.2338000    
 O   -2.696300      -1.241100     -0.4330000    
 N    2.639000       1.645200     -0.5763000    
 N   -2.964300       1.330900     -0.7852000    
 N    5.179500       1.776100      0.7411000    
 N   -5.223400       1.250000      0.9374000    
 C   0.5993000      0.2468000     -0.4828000    
 C  -0.7940000      0.1686000     -0.5348000    
 C    1.234700       1.487000     -0.6183000    
 C   -1.552000       1.330800     -0.7221000    
 C   0.7280000      -2.273400     -0.1437000    
 C  -0.6653000      -2.351400     -0.1953000    
 C    1.411200     -0.9714000     -0.2853000    
 C   -1.477200      -1.133400     -0.3929000    
 C   0.4755000       2.642500     -0.8050000    
 C  -0.9147000       2.564700     -0.8567000    
 C    3.268200       2.897100     -0.2989000    
 C   -3.748400       2.503500     -0.5605000    
 C    1.486000      -3.435500      4.3699998E-02
 C    4.781200       2.719700     -0.2959000    
 C   -5.183800       2.105900     -0.2417000    
 C   -1.300700      -3.591600     -5.8899999E-02
 C   0.8488000      -4.669200      0.1788000    
 C  -0.5415000      -4.747100      0.1276000    
 C    1.656500      -5.907200      0.3784000    
 C    4.733500       2.237300       2.057200    
 C    6.631100       1.585600      0.7357000    
 C   -6.596700      0.8327000       1.226400    
 C   -4.648500       1.938600       2.094600    
 H   0.9164000       3.626700     -0.9274000    
 H   -1.457600       3.490200      -1.025500    
 H    3.198900      0.8033000     -0.5155000    
 H   -3.431100      0.4329000     -0.8205000    
 H    3.053200       3.607700      -1.107200    
 H    2.895300       3.355000      0.6235000    
 H   -3.339600       3.146700      0.2270000    
 H   -3.762700       3.108200      -1.476100    
 H    2.571600      -3.391300      8.8000000E-02
 H    5.098300       2.343000      -1.277300    
 H    5.261000       3.696900     -0.1539000    
 H   -5.790700       3.010200     -0.1041000    
 H   -5.600600       1.565400      -1.101700    
 H   -2.383100      -3.681300     -9.4499998E-02
 H   -1.047800      -5.703000      0.2337000    
 H    1.126000      -6.792200      1.0800000E-02
 H    1.872800      -6.046900       1.442300    
 H    2.603200      -5.851200     -0.1696000    
 H    5.164200       1.608100       2.846000    
 H    5.030300       3.272500       2.261600    
 H    3.650900       2.139100       2.183200    
 H    6.923900      0.8317000       1.475100    
 H    7.170900       2.513800      0.9555000    
 H    6.966500       1.213300     -0.2387000    
 H   -6.619200      0.1426000       2.077200    
 H   -7.021400      0.2906000      0.3740000    
 H   -7.248400       1.684100       1.453900    
 H   -5.090200       2.929000       2.254800    
 H   -4.814100       1.351300       3.006300    
 H   -3.561200       2.035500       2.019600    


%chk=000135483-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000135483

0 1
O 2.777297 -0.817343 0.056996
O -2.756492 -1.082265 0.174993
N 2.704469 1.761564 -0.164171
N -2.938705 1.492794 -0.053867
N 5.521770 1.741740 0.355803
N -5.720275 1.216385 0.576545
C 0.669828 0.382240 -0.006536
C -0.777910 0.313842 0.023047
C 1.334236 1.661844 -0.110476
C -1.564115 1.523618 -0.053970
C 0.781048 -2.149461 0.159540
C -0.639305 -2.213537 0.189399
C 1.477722 -0.841455 0.067594
C -1.461181 -0.981550 0.129459
C 0.517743 2.847932 -0.154660
C -0.866881 2.781686 -0.128562
C 3.446022 3.017476 -0.255011
C -3.801082 2.669886 -0.133598
C 1.542709 -3.345387 0.221053
C 4.928972 2.726660 -0.568864
C -5.257591 2.228423 -0.392099
C -1.272957 -3.480769 0.281718
C 0.919117 -4.606970 0.309740
C -0.507247 -4.655684 0.339948
C 1.732224 -5.887303 0.370566
C 5.652865 2.221350 1.743811
C 6.764785 1.138672 -0.160317
C -6.896685 0.458910 0.110199
C -5.877869 1.727286 1.950515
H 0.998890 3.829277 -0.200288
H -1.441900 3.711950 -0.153464
H 3.230264 0.866654 -0.049176
H -3.372249 0.553779 0.088501
H 3.047711 3.657872 -1.068973
H 3.355914 3.605854 0.684911
H -3.738955 3.279227 0.795251
H -3.494218 3.333233 -0.968686
H 2.633637 -3.252518 0.197345
H 4.994847 2.305247 -1.589566
H 5.479799 3.703744 -0.575041
H -5.902804 3.145616 -0.405036
H -5.310873 1.774285 -1.399405
H -2.366774 -3.504379 0.305763
H -1.007662 -5.629567 0.410089
H 1.500732 -6.548934 -0.485762
H 1.510148 -6.460208 1.290846
H 2.815136 -5.678989 0.354075
H 6.035918 1.402312 2.377189
H 6.346600 3.095056 1.845678
H 4.667344 2.514622 2.144625
H 7.090388 0.329422 0.517058
H 7.609381 1.867584 -0.257411
H 6.577968 0.692888 -1.153269
H -7.112282 -0.358411 0.820909
H -6.680564 0.003537 -0.872304
H -7.821262 1.083053 0.011367
H -6.668479 2.515957 2.039320
H -6.147226 0.892961 2.621386
H -4.926143 2.150194 2.315575


