%chk=000028787.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028787

0 1
 N   0.6006000      0.6639000     -0.4912000    
 N    3.504300      -1.638700     -4.1499998E-02
 N   -1.456200       1.307600      5.2099999E-02
 C    1.695400     -0.2067000     -0.8562000    
 C    2.426700     -0.7473000      0.3691000    
 C  -0.6929000      0.2850000     -0.2623000    
 C   0.6772000       2.021400     -0.3123000    
 C  -0.6193000       2.399500      2.6100000E-02
 C   -1.130400      -1.122000     -0.3708000    
 C    2.990000      -2.797600     -0.8193000    
 C    4.277300      -2.081700       1.120600    
 C    1.736700       2.923500     -0.4142000    
 C   -2.610200      -1.332300     -7.8699999E-02
 C  -0.8931000       3.753800      0.2813000    
 C    4.119300      -3.669600      -1.328000    
 C    4.804200     -0.9060000       1.917500    
 C    1.446300       4.267300     -0.1567000    
 C   0.1554000       4.677100      0.1848000    
 C   -3.512100      -1.255000      -1.119800    
 C   -3.002900      -1.594000       1.217600    
 C   -4.867400      -1.447700     -0.8525000    
 C   -4.358300      -1.786900       1.484700    
 C   -5.290600      -1.713700      0.4496000    
 H    1.254600     -0.9788000      -1.488000    
 H    2.378700      0.3620000      -1.498600    
 H    2.805500      0.1289000      0.9053000    
 H    1.727100      -1.257700       1.043600    
 H  -0.5474000      -1.753900      0.3111000    
 H  -0.9263000      -1.503300      -1.379800    
 H    2.287800      -3.393800     -0.2241000    
 H    2.469800      -2.468500      -1.721100    
 H    3.686100      -2.734900       1.774600    
 H    5.156500      -2.648000      0.7963000    
 H    2.740700       2.609800     -0.6761000    
 H   -1.892700       4.082200      0.5475000    
 H    4.893200      -3.078000      -1.828700    
 H    4.584300      -4.256300     -0.5300000    
 H    3.731600      -4.387800      -2.059300    
 H    5.269300     -0.1504000       1.275000    
 H    4.030400     -0.4313000       2.529000    
 H    5.574900      -1.254200       2.615000    
 H    2.241200       5.006200     -0.2233000    
 H  -3.9400000E-02   5.728700      0.3793000    
 H   -3.190800      -1.046300      -2.135700    
 H   -2.283300      -1.650500       2.028700    
 H   -5.593400      -1.390100      -1.658300    
 H   -4.687900      -1.993400       2.498700    
 H   -6.345900      -1.863500      0.6578000    


%chk=000028787-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028787

0 1
N 0.373083 1.023034 -0.997081
N 2.423144 -1.782636 0.559168
N -1.517317 2.289578 -1.293240
C 1.276292 -0.136502 -0.917499
C 1.460651 -0.657908 0.533616
C -0.977848 1.058672 -1.400087
C 0.713184 2.329900 -0.606040
C -0.477401 3.109206 -0.798538
C -1.730337 -0.141117 -1.908011
C 1.774943 -3.110397 0.377495
C 3.376804 -1.737400 1.698741
C 1.917538 2.895205 -0.136186
C -2.061783 -1.196945 -0.848857
C -0.472823 4.491257 -0.504407
C 2.705262 -4.149433 -0.277179
C 4.444460 -0.637214 1.545161
C 1.902610 4.277261 0.150125
C 0.725632 5.063096 -0.028554
C -2.526404 -0.811444 0.435014
C -1.955528 -2.577420 -1.150142
C -2.875690 -1.786790 1.394912
C -2.305233 -3.556374 -0.190996
C -2.765188 -3.163539 1.086581
H 0.877636 -0.943031 -1.555604
H 2.266810 0.143265 -1.319396
H 1.844042 0.169936 1.156192
H 0.466475 -0.938594 0.949501
H -1.182692 -0.616986 -2.744856
H -2.668691 0.261862 -2.331429
H 1.386485 -3.507220 1.348921
H 0.888151 -2.968898 -0.267491
H 2.843813 -1.613093 2.675107
H 3.888554 -2.716057 1.744653
H 2.829406 2.302741 -0.002268
H -1.377643 5.089267 -0.650110
H 3.046995 -3.787978 -1.262908
H 3.600773 -4.347923 0.339148
H 2.174940 -5.110592 -0.413927
H 5.010593 -0.785238 0.609002
H 3.994870 0.372927 1.519307
H 5.150676 -0.662643 2.395950
H 2.816235 4.758626 0.516672
H 0.758723 6.132485 0.207071
H -2.618485 0.255155 0.672512
H -1.606222 -2.889079 -2.143067
H -3.237108 -1.474280 2.381281
H -2.220282 -4.620151 -0.440923
H -3.037506 -3.919593 1.831466


