%chk=000168912.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168912

0 1
 N    1.077300      0.8351000      -1.009300    
 N   -4.263400      -2.032000     -0.3194000    
 C  -0.7790000     -0.8961000      0.5660000    
 C  -0.8296000      0.5904000      0.5605000    
 C   1.2300000E-02   1.386600     -0.2521000    
 C   -2.093500      -1.630500      0.7015000    
 C    2.068500     -1.8100001E-02 -0.4674000    
 C    1.730000      -1.143500      0.3081000    
 C   0.3499000      -1.619600      0.4664000    
 C   -3.004400      -1.311100     -0.4705000    
 C   -1.822500       1.228100       1.338200    
 C  -0.2023000       2.787000     -0.2635000    
 C    1.387600       1.481900      -2.289100    
 C    3.441500      0.2564000     -0.6599000    
 C    2.745400      -1.951600      0.8562000    
 C   -2.001900       2.610100       1.314400    
 C   -1.194700       3.390900      0.5065000    
 C    4.438800     -0.5455000     -0.1024000    
 C    4.090200      -1.649900      0.6596000    
 C   -5.150100      -1.768700      -1.443700    
 H   -2.573400      -1.405200       1.660800    
 H   -1.925600      -2.716700      0.7254000    
 H   0.2688000      -2.705900      0.5058000    
 H   -3.213400     -0.2381000     -0.5403000    
 H   -2.514800      -1.613400      -1.405300    
 H   -2.479800      0.6648000       1.995200    
 H   0.4303000       3.441500     -0.8593000    
 H    2.019400       2.367000      -2.154200    
 H   0.4710000       1.784500      -2.810400    
 H    1.901300      0.7883000      -2.966100    
 H    3.760800       1.124100      -1.233100    
 H    2.494000      -2.835800       1.439400    
 H   -2.772600       3.069800       1.925600    
 H   -1.324200       4.468600      0.4805000    
 H    5.484700     -0.3017000     -0.2632000    
 H    4.860100      -2.281200       1.092700    
 H   -4.720600      -1.745400      0.5458000    
 H   -4.702700      -2.096500      -2.387700    
 H   -5.403100     -0.7059000      -1.516800    
 H   -6.081800      -2.327300      -1.311000    


%chk=000168912-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168912

0 1
N 1.101160 0.857001 -1.037323
N -4.370226 -2.102034 -0.291965
C -0.817899 -0.842240 0.525272
C -0.840253 0.648144 0.538770
C 0.085684 1.452026 -0.205795
C -2.145843 -1.579901 0.684465
C 2.102187 0.019895 -0.434608
C 1.723915 -1.162519 0.278404
C 0.327260 -1.594567 0.431793
C -3.107950 -1.364033 -0.510069
C -1.839304 1.324993 1.294461
C -0.036708 2.867032 -0.180427
C 1.487157 1.590934 -2.256153
C 3.479875 0.311624 -0.615095
C 2.751308 -2.007379 0.781343
C -1.951413 2.729992 1.320087
C -1.047647 3.507629 0.565827
C 4.481116 -0.543348 -0.104024
C 4.118100 -1.709444 0.605350
C -5.320177 -2.033579 -1.418149
H -2.665396 -1.269029 1.615119
H -1.963839 -2.664549 0.782863
H 0.204937 -2.682630 0.534163
H -3.264992 -0.269377 -0.674527
H -2.633488 -1.758714 -1.429319
H -2.551347 0.733093 1.878013
H 0.671511 3.476657 -0.749765
H 2.149866 2.468358 -2.083072
H 0.573765 1.950545 -2.759307
H 2.013832 0.898535 -2.934898
H 3.776990 1.212223 -1.161167
H 2.457789 -2.922592 1.310109
H -2.737798 3.207519 1.914082
H -1.121179 4.600862 0.559501
H 5.537071 -0.298011 -0.264106
H 4.886009 -2.382020 1.001562
H -4.810640 -1.831324 0.598313
H -4.876548 -2.526355 -2.303319
H -5.604708 -0.995565 -1.721622
H -6.243678 -2.582456 -1.160890


