%chk=000044668.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044668

0 1
 N    5.190600     -0.9703000     -0.1792000    
 N   -3.060100       1.889100      1.1500000E-02
 C    2.673200      0.5284000      1.4500000E-02
 C    2.889900     -0.8106000      0.7307000    
 C    3.593200      0.6218000      -1.209500    
 C    1.210900      0.7072000     -0.3837000    
 C    4.370400      -1.042400       1.032000    
 C    5.046000      0.3326000     -0.8321000    
 C   0.2996000      0.7257000      0.8435000    
 C   -1.140200      0.9235000      0.4740000    
 C   -2.066200     -0.1004000      0.1888000    
 C   -1.759200       2.132400      0.3624000    
 C   -3.276000      0.5341000     -0.1015000    
 C   -2.010800      -1.507600      0.1446000    
 C   -4.437600     -0.1711000     -0.4352000    
 C   -3.165000      -2.226200     -0.1880000    
 C   -4.358600      -1.566100     -0.4729000    
 H    2.949600       1.337200      0.7051000    
 H    2.507700      -1.635300      0.1152000    
 H    2.353700     -0.8422000       1.684300    
 H    3.524600       1.621300      -1.655000    
 H    3.268400     -9.2399999E-02  -1.977500    
 H   0.9027000     -9.4499998E-02  -1.067400    
 H    1.095700       1.647700     -0.9382000    
 H    4.725800     -0.3129000       1.770400    
 H    4.492800      -2.034600       1.480200    
 H    5.659000      0.3408000      -1.740100    
 H    5.432300       1.125100     -0.1794000    
 H   0.6115000       1.527100       1.525600    
 H   0.3727000     -0.2085000       1.409500    
 H    6.169000      -1.115800      6.8099998E-02
 H   -1.405700       3.145100      0.4968000    
 H   -3.761100       2.600700     -0.1426000    
 H   -1.088200      -2.038100      0.3624000    
 H   -5.367400      0.3418000     -0.6573000    
 H   -3.128000      -3.311700     -0.2242000    
 H   -5.243000      -2.144000     -0.7288000    


%chk=000044668-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044668

0 1
N 5.252258 -0.968639 -0.151917
N -3.232778 1.949125 0.190542
C 2.689519 0.445611 0.026202
C 3.013955 -0.804810 0.886594
C 3.536962 0.410386 -1.272575
C 1.181646 0.577184 -0.301463
C 4.531788 -0.930735 1.139068
C 5.040704 0.250338 -0.963323
C 0.279551 0.838819 0.937938
C -1.179868 1.009678 0.590533
C -2.099938 -0.034264 0.162059
C -1.909790 2.198004 0.595838
C -3.378790 0.584338 -0.081363
C -1.970418 -1.436170 -0.031096
C -4.507496 -0.150012 -0.508309
C -3.091985 -2.174942 -0.455153
C -4.346956 -1.538446 -0.693290
H 2.997003 1.345583 0.607648
H 2.666116 -1.711701 0.352478
H 2.486983 -0.760816 1.859026
H 3.373376 1.337570 -1.857112
H 3.211026 -0.444153 -1.898111
H 0.837955 -0.340130 -0.821263
H 1.036229 1.411137 -1.018003
H 4.854161 -0.070625 1.783728
H 4.749411 -1.862017 1.694664
H 5.616407 0.156630 -1.903006
H 5.395349 1.178043 -0.441067
H 0.649097 1.744741 1.458513
H 0.390477 0.000144 1.654036
H 6.247165 -1.202097 -0.042069
H -1.584839 3.202997 0.860633
H -3.968653 2.647494 0.118645
H -1.012755 -1.937769 0.150141
H -5.474332 0.333296 -0.690041
H -3.005555 -3.256680 -0.607426
H -5.200785 -2.140213 -1.024698


