%chk=000056730.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056730

1 1
 N   -2.442400     -0.2127000     -0.3408000    
 N    2.757400     -0.3420000      0.1966000    
 N    4.503100      -1.407700     -0.8938000    
 N    4.883400      0.7171000     -0.1618000    
 C   -1.532000      0.1058000      0.7855000    
 C   -3.875200     -0.4387000      0.1623000    
 C   -2.471400      0.9341000      -1.361200    
 C  -0.1325000      0.3537000      0.2409000    
 C   -1.987000      -1.485700      -1.068300    
 C   0.8538000      0.6415000       1.376300    
 C   -3.890400      -1.618300       1.109800    
 C   -2.917800       2.204300     -0.6708000    
 C    2.275500      0.8636000      0.8726000    
 C    3.975500     -0.3148000     -0.2472000    
 H   -1.478600     -0.7610000       1.452500    
 H   -1.920300      0.9430000       1.373000    
 H   -4.209700      0.4448000      0.7105000    
 H   -4.523900     -0.6095000     -0.7038000    
 H   -1.498100       1.033400      -1.848800    
 H   -3.192300      0.6535000      -2.139100    
 H  -9.5500000E-02   1.222700     -0.4216000    
 H   0.2374000     -0.5094000     -0.3191000    
 H   -1.656400      -2.229900     -0.3386000    
 H   -2.822800      -1.864800      -1.665200    
 H   -1.164200      -1.238600      -1.745800    
 H   0.5276000       1.530900       1.928900    
 H   0.8488000     -0.1975000       2.083500    
 H   -4.927300      -1.796100       1.420800    
 H   -3.551300      -2.554100      0.6595000    
 H   -3.334900      -1.440300       2.034000    
 H   -2.928900       3.006700      -1.419400    
 H   -3.935800       2.169000     -0.2784000    
 H   -2.236800       2.549500      0.1103000    
 H    2.287800       1.719300      0.1867000    
 H    2.912600       1.098400       1.733800    
 H    3.953600      -2.248400      -1.034700    
 H    5.453100      -1.406400      -1.248600    
 H    5.816800      0.6249000     -0.5479000    
 H    4.658800       1.600100      0.2825000    


%chk=000056730-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000056730

1 1
N -2.440696 -0.232660 -0.368345
N 2.696170 -0.135425 0.014970
N 4.305688 -1.538986 -0.955453
N 5.046876 0.459543 0.019308
C -1.432974 0.171164 0.745450
C -3.817411 -0.565672 0.268119
C -2.630015 0.911332 -1.402402
C -0.066474 0.649875 0.245112
C -1.916339 -1.448021 -1.128182
C 0.924703 0.808128 1.424730
C -3.837908 -1.784624 1.198608
C -3.138202 2.240494 -0.834472
C 2.364838 1.001753 0.893255
C 3.960410 -0.364571 -0.286340
H -1.308873 -0.727153 1.373510
H -1.939424 0.944024 1.349901
H -4.126712 0.337749 0.818380
H -4.512045 -0.709844 -0.578783
H -1.648556 1.046654 -1.884580
H -3.329634 0.513225 -2.159153
H -0.149851 1.617746 -0.285947
H 0.415826 -0.077826 -0.435744
H -1.638620 -2.237894 -0.416623
H -2.703611 -1.812211 -1.806811
H -1.029968 -1.156632 -1.708432
H 0.643398 1.661062 2.073064
H 0.913182 -0.109735 2.044696
H -4.866943 -1.889852 1.585570
H -3.592185 -2.727689 0.683863
H -3.178805 -1.668452 2.074292
H -3.175219 2.965963 -1.666336
H -4.157801 2.177678 -0.421183
H -2.464032 2.663095 -0.071149
H 2.413714 1.973774 0.346728
H 3.049758 1.088514 1.768717
H 3.561907 -2.215717 -1.103425
H 5.134271 -1.586574 -1.543657
H 5.998346 0.099223 0.021607
H 4.892911 1.398944 0.372241


