%chk=000116400.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116400

0 1
 S   4.6700001E-02  1.6000000E-03   3.222900    
 N   -3.635800       2.459400     -0.6418000    
 N    3.625200      -2.459700     -0.6478000    
 C   -1.255000      5.7999999E-03  0.7737000    
 C    1.292400     -5.7999999E-03  0.7444000    
 C   -3.061700      -1.193100     -0.2915000    
 C    3.051800       1.192900     -0.2979000    
 C   -3.656100      1.7800000E-02 -0.6465000    
 C    3.645500     -1.8200001E-02 -0.6535000    
 C  -3.1999999E-03  3.0000001E-04   1.514200    
 C   -1.861200      -1.199200      0.4186000    
 C    1.852600       1.199300      0.4145000    
 C   -3.050000       1.222800     -0.2912000    
 C    3.040000      -1.223000     -0.2966000    
 C   -1.849300       1.216800      0.4187000    
 C    1.840800      -1.216700      0.4157000    
 C   -3.690100      -2.497400     -0.6594000    
 C    3.679400       2.497000     -0.6676000    
 C   -4.943600      2.0700000E-02  -1.409800    
 C    4.931500     -2.1400001E-02  -1.419200    
 H   -1.395300      -2.141700      0.6971000    
 H    1.380600       2.135800      0.6968000    
 H   -1.377000       2.157100      0.6954000    
 H    1.362400      -2.150500      0.6972000    
 H   -4.679700      -2.596000     -0.2012000    
 H   -3.767200      -2.599700      -1.746800    
 H   -3.092800      -3.345200     -0.3048000    
 H    3.081900       3.344700     -0.3129000    
 H    4.669500       2.596400     -0.2106000    
 H    3.755200       2.598600      -1.755200    
 H   -5.718200      0.5418000     -0.8359000    
 H   -4.808000      0.5301000      -2.370600    
 H   -5.345500     -0.9680000      -1.639900    
 H    5.706600     -0.5443000     -0.8477000    
 H    4.793600     -0.5289000      -2.380600    
 H    5.334200      0.9673000      -1.648100    
 H   -4.504700       2.499900      -1.155400    
 H   -3.179500       3.321700     -0.3736000    
 H    3.168800      -3.321800     -0.3792000    
 H    4.492200      -2.500500      -1.164600    


%chk=000116400-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000116400

0 1
S 0.106058 -0.187326 3.094358
N -2.979084 1.083528 -2.366951
N 2.838634 -0.853257 -2.650198
C -1.238621 -0.259119 0.658000
C 1.292473 0.157001 0.600660
C -3.508167 -1.230573 0.531168
C 3.554459 1.140785 0.439399
C -3.766705 -0.509843 -0.671952
C 3.736043 0.551890 -0.846683
C 0.050643 -0.092003 1.381544
C -2.263941 -1.092509 1.184008
C 2.351848 0.931256 1.148857
C -2.746685 0.347568 -1.198090
C 2.681236 -0.245358 -1.398127
C -1.493693 0.454842 -0.542243
C 1.469543 -0.423134 -0.682758
C -4.556930 -2.153013 1.134923
C 4.642117 1.995612 1.073460
C -5.087761 -0.606658 -1.413604
C 5.011030 0.727385 -1.651704
H -2.066465 -1.630739 2.116341
H 2.214797 1.365061 2.144335
H -0.729926 1.129354 -0.944742
H 0.678740 -1.050829 -1.108100
H -5.484903 -1.607728 1.392734
H -4.839132 -2.968954 0.442177
H -4.176894 -2.617140 2.060036
H 4.318878 2.360800 2.062308
H 5.580332 1.426760 1.218872
H 4.888895 2.879468 0.454335
H -5.604840 0.375026 -1.451691
H -4.940401 -0.940543 -2.461473
H -5.779982 -1.317582 -0.938783
H 5.516279 -0.245124 -1.829324
H 4.804662 1.176121 -2.645273
H 5.736567 1.379266 -1.143115
H -3.883680 1.073679 -2.825443
H -2.266205 1.712676 -2.723712
H 2.102898 -1.443535 -3.026483
H 3.714882 -0.796407 -3.157766


