%chk=000048886.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048886

0 1
 N    2.346400      0.5749000     -0.1262000    
 N   0.4214000     -0.5347000      0.6360000    
 N    2.285600      -1.832700     -0.1301000    
 N   -2.449600      0.6659000      0.6311000    
 N    4.607900      -1.819700      -1.063300    
 C    1.849700       1.914800      9.0099998E-02
 C    2.928900       2.915500     -0.3324000    
 C   0.5877000       2.107100     -0.7541000    
 C    1.526000       2.087000       1.576800    
 C    1.624700     -0.5759000      0.1508000    
 C  -0.2903000      -1.773300      0.9081000    
 C   -1.672500      -1.465100       1.477300    
 C   -2.536600     -0.6718000      0.5281000    
 C   -3.339800      -1.350900     -0.3613000    
 C   -4.123700     -0.5902000      -1.221900    
 C   -3.225700       1.372000     -0.2214000    
 C   -4.071400      0.7977000      -1.157000    
 C    3.531200      -1.820600     -0.6305000    
 H    3.192500       2.792100      -1.389400    
 H    2.592500       3.948400     -0.1895000    
 H    3.847400       2.777900      0.2503000    
 H  -0.2505000       1.487700     -0.4434000    
 H   0.7826000       1.883400      -1.809900    
 H   0.2441000       3.146900     -0.6985000    
 H    2.374700       1.790700       2.204600    
 H    1.303600       3.137300       1.800700    
 H   0.6554000       1.514400       1.907600    
 H    3.285700      0.5011000     -0.5042000    
 H   0.2558000      -2.374000       1.645300    
 H  -0.4022000      -2.362100     -1.0800000E-02
 H   -1.565500     -0.8951000       2.409500    
 H   -2.178700      -2.399800       1.748400    
 H    1.796100      -2.700500      5.7399999E-02
 H   -3.370200      -2.433800     -0.4035000    
 H   -4.773400      -1.078100      -1.942200    
 H   -3.146900       2.450400     -0.1315000    
 H   -4.672900       1.410700      -1.818300    


%chk=000048886-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048886

0 1
N 2.325361 0.487146 -0.096297
N 0.393558 -0.593873 0.764525
N 2.285711 -1.884833 -0.033952
N -3.059650 0.545176 1.078482
N 4.570647 -2.025423 -1.154654
C 1.860117 1.907079 0.017897
C 3.027339 2.773107 -0.516877
C 0.593506 2.126838 -0.849500
C 1.569893 2.261597 1.499797
C 1.590485 -0.627661 0.245332
C -0.349275 -1.829337 1.058753
C -1.751467 -1.469201 1.607289
C -2.601236 -0.668145 0.634870
C -2.917014 -1.155255 -0.661481
C -3.713483 -0.373518 -1.524319
C -3.832368 1.290811 0.234244
C -4.183290 0.881423 -1.071276
C 3.491732 -1.985407 -0.625236
H 3.250667 2.536037 -1.574239
H 2.756174 3.840764 -0.458186
H 3.944848 2.623761 0.083725
H -0.228787 1.485542 -0.493043
H 0.801467 1.891390 -1.909271
H 0.273688 3.182757 -0.781660
H 2.475155 2.122786 2.118889
H 1.251912 3.317376 1.576897
H 0.764595 1.619523 1.891308
H 3.276821 0.343942 -0.441473
H 0.160589 -2.450856 1.833468
H -0.467205 -2.473213 0.153471
H -1.636569 -0.864555 2.521900
H -2.274108 -2.409170 1.877833
H 1.807670 -2.737033 0.262388
H -2.541417 -2.132447 -0.985513
H -3.965488 -0.734456 -2.527529
H -4.176945 2.252821 0.632227
H -4.803634 1.522109 -1.706089


