%chk=000049664.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000049664

0 1
 N   -2.585400      0.3538000      0.1787000    
 C    1.191900     -0.3313000      0.3921000    
 C  -0.1443000      0.3648000      0.6039000    
 C   -1.330000     -0.3601000     -5.4200001E-02
 C    1.623400     -0.3291000      -1.081900    
 C    3.142800     -0.1590000      -1.075700    
 C    2.334500      0.3698000       1.059900    
 C    3.399400      0.4586000      0.2572000    
 C   -1.461600      -1.779700      0.4957000    
 C   -3.691700     -0.3256000     -0.4943000    
 C   -2.479200       1.737700     -0.2814000    
 H    1.183600      -1.350600      0.7910000    
 H  -3.8600001E-02   1.385300      0.2176000    
 H  -0.3320000      0.4631000       1.682500    
 H   -1.138800     -0.4311000      -1.133700    
 H    1.170100      0.5077000      -1.630200    
 H    1.323800      -1.249000      -1.595800    
 H    3.470200      0.4881000      -1.894600    
 H    3.657700      -1.121800      -1.155100    
 H    2.317500      0.7178000       2.083000    
 H    4.345400      0.8924000      0.5474000    
 H   -2.222900      -2.368900     -2.4700001E-02
 H   -1.698900      -1.778300       1.565700    
 H  -0.5446000      -2.359300      0.3598000    
 H   -3.969200      -1.258200      5.9000002E-03
 H   -3.482900     -0.5268000      -1.551400    
 H   -4.600700      0.2871000     -0.4504000    
 H   -3.461600       2.225800     -0.2616000    
 H   -2.095400       1.813600      -1.305400    
 H   -1.861400       2.344400      0.3880000    


%chk=000049664-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000049664

0 1
N -2.531776 0.444302 0.079699
C 1.250103 -0.419406 0.348389
C -0.128537 0.177827 0.733287
C -1.335405 -0.457586 -0.015311
C 1.682152 -0.138136 -1.133036
C 3.218691 0.148578 -1.095989
C 2.407711 0.171786 1.148733
C 3.473873 0.485097 0.367984
C -1.626800 -1.857658 0.569108
C -3.823971 -0.205937 -0.235696
C -2.379324 1.663293 -0.747818
H 1.220926 -1.517063 0.529115
H -0.086645 1.266340 0.544414
H -0.305006 0.057968 1.821243
H -1.055072 -0.587633 -1.095699
H 1.147103 0.761903 -1.493370
H 1.427534 -0.967995 -1.815229
H 3.511818 0.966386 -1.781676
H 3.809468 -0.741618 -1.397357
H 2.363094 0.290168 2.237755
H 4.423785 0.895101 0.728406
H -2.345477 -2.431952 -0.040260
H -2.024155 -1.767917 1.597329
H -0.693220 -2.445610 0.615255
H -4.033334 -1.026022 0.468783
H -3.878563 -0.615243 -1.277847
H -4.631296 0.540614 -0.125778
H -3.247828 2.326794 -0.587308
H -2.313591 1.438692 -1.844384
H -1.475159 2.226126 -0.464744


