%chk=000040670.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040670

0 1
 N  -0.2123000      0.5153000     -3.5399999E-02
 C    2.252300      0.5399000      0.3603000    
 C    2.238700     -0.9461000      0.7914000    
 C    3.579400      0.9855000     -0.2960000    
 C    1.083100      0.9092000     -0.5791000    
 C    2.392700      -1.955500     -0.3494000    
 C    4.810700      0.7698000      0.5871000    
 C   -1.286600      0.8572000     -0.9564000    
 C    2.294100      -3.385200      0.1635000    
 C    6.083500       1.211000     -0.1201000    
 C   -2.634500      0.4539000     -0.4203000    
 C   -3.134300     -0.8086000     -0.7076000    
 C   -3.358100       1.350100      0.3539000    
 C   -4.382900      -1.182500     -0.2108000    
 C   -4.606700      0.9762000      0.8507000    
 C   -5.119100     -0.2902000      0.5683000    
 H    2.131700       1.131200       1.279600    
 H    3.024200      -1.119800       1.536100    
 H    1.300800      -1.154000       1.322500    
 H    3.510900       2.053400     -0.5418000    
 H    3.717400      0.4608000      -1.249300    
 H    1.237200      0.4345000      -1.556000    
 H    1.095800       1.994300     -0.7453000    
 H    1.615000      -1.804500      -1.105000    
 H    3.360800      -1.824500     -0.8441000    
 H    4.921800     -0.2877000      0.8457000    
 H    4.700000       1.328200       1.523500    
 H  -0.3584000      0.9856000      0.8578000    
 H   -1.129900      0.3643000      -1.925000    
 H   -1.291100       1.936000      -1.161300    
 H    2.411100      -4.092900     -0.6633000    
 H    1.321600      -3.568100      0.6317000    
 H    3.076200      -3.592000      0.9010000    
 H    6.951600       1.050600      0.5270000    
 H    6.237600      0.6420000      -1.042500    
 H    6.042000       2.274800     -0.3746000    
 H   -2.568200      -1.512200      -1.311700    
 H   -2.967500       2.338000      0.5812000    
 H   -4.781600      -2.168700     -0.4301000    
 H   -5.179900       1.670700       1.457900    
 H   -6.091100     -0.5814000      0.9555000    


%chk=000040670-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000040670

0 1
N -0.220107 0.667788 -0.015100
C 2.254200 0.444171 0.343988
C 2.183087 -1.093760 0.568424
C 3.625872 0.938161 -0.191640
C 1.115680 0.951902 -0.579412
C 2.528263 -1.968147 -0.660294
C 4.834014 0.583296 0.704869
C -1.357869 1.068758 -0.868602
C 2.367841 -3.475035 -0.361074
C 6.154908 1.191591 0.184893
C -2.696050 0.613260 -0.294741
C -2.817508 -0.651986 0.335175
C -3.845851 1.434008 -0.406742
C -4.064505 -1.088771 0.834212
C -5.096695 0.997213 0.087808
C -5.210154 -0.267193 0.710328
H 2.102125 0.921539 1.340252
H 2.858110 -1.372682 1.403010
H 1.153711 -1.337823 0.896504
H 3.584770 2.042153 -0.306579
H 3.796649 0.531054 -1.209866
H 1.180819 0.449532 -1.565886
H 1.276586 2.043887 -0.772104
H 1.872924 -1.696114 -1.511244
H 3.568631 -1.770393 -0.987717
H 4.940793 -0.517104 0.772707
H 4.640676 0.942052 1.736786
H -0.317568 1.039152 0.940799
H -1.200940 0.592960 -1.859698
H -1.399922 2.170515 -1.061455
H 2.619272 -4.094665 -1.241797
H 1.327228 -3.709223 -0.067185
H 3.027696 -3.786067 0.471339
H 7.009341 0.920030 0.831896
H 6.378749 0.834271 -0.838245
H 6.096264 2.295990 0.147388
H -1.920900 -1.273696 0.431062
H -3.762474 2.419914 -0.881949
H -4.144951 -2.069053 1.318453
H -5.976987 1.643494 -0.006515
H -6.177731 -0.606380 1.097550


