%chk=000031919.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031919

0 1
 N   -1.471300     -0.5617000      0.6318000    
 N    1.004300      0.1647000     -0.6416000    
 N   -5.418500       1.177100      7.6399997E-02
 C  -0.1996000     -0.9433000       1.265100    
 C   -1.350600     -0.6914000     -0.8284000    
 C   0.2039000      -2.398600      0.9471000    
 C   -1.013100      -2.132200      -1.266500    
 C   0.8660000      8.5699998E-02  0.8182000    
 C  -0.2974000      0.3404000      -1.298400    
 C   0.1924000      -2.733900     -0.5444000    
 C   -2.632000      -1.246900       1.187500    
 C    1.942200       1.213300      -1.031200    
 C   -3.920000     -0.7420000      0.5380000    
 C   -4.153900      0.7657000      0.6736000    
 C    3.303000      0.9457000     -0.4505000    
 C    3.626800       1.455600      0.8002000    
 C    4.220100      0.1921000      -1.171700    
 C   -5.420100      0.9098000      -1.363100    
 C   -5.670900       2.596800      0.3290000    
 C    4.889200       1.207400       1.339000    
 C    5.482500     -5.5900000E-02 -0.6328000    
 C    5.817100      0.4517000      0.6226000    
 H  -0.2939000     -0.8457000       2.354800    
 H   -2.266700     -0.3888000      -1.344400    
 H  -0.4812000      -3.082800       1.463100    
 H    1.199200      -2.609800       1.356800    
 H  -0.8364000      -2.162700      -2.348600    
 H   -1.883700      -2.775500      -1.087200    
 H   0.5991000       1.067700       1.233400    
 H    1.797800     -0.2397000       1.290100    
 H  -0.1724000      0.2482000      -2.384700    
 H  -0.6838000       1.351400      -1.105500    
 H    1.118500      -2.379400      -1.010600    
 H   0.1972000      -3.822300     -0.6779000    
 H   -2.580600      -2.334900       1.071500    
 H   -2.688600      -1.047100       2.264900    
 H    1.590800       2.206800     -0.7202000    
 H    2.028900       1.255200      -2.125100    
 H   -4.753000      -1.256400       1.038700    
 H   -3.967700      -1.089300     -0.4972000    
 H   -3.322300       1.328100      0.2308000    
 H   -4.162700       1.006900       1.744600    
 H    2.921900       2.059800       1.364300    
 H    3.969700     -0.2102000      -2.149300    
 H   -5.477600     -0.1605000      -1.580700    
 H   -4.544300       1.333100      -1.868400    
 H   -6.314000       1.341700      -1.829500    
 H   -6.646300       2.892700     -7.3100001E-02
 H   -4.903400       3.239200     -0.1180000    
 H   -5.704500       2.796800       1.405900    
 H    5.151000       1.605600       2.314900    
 H    6.204900     -0.6448000      -1.190500    
 H    6.800400      0.2591000       1.041900    


%chk=000031919-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000031919

0 1
N -1.538730 -0.712018 0.390653
N 1.047091 0.177386 -0.559474
N -5.566474 1.218592 0.205862
C -0.309064 -1.032933 1.175596
C -1.213886 -0.811918 -1.064061
C 0.201731 -2.482089 0.904273
C -0.765320 -2.249707 -1.467573
C 0.730536 0.074035 0.887735
C -0.181435 0.295319 -1.383735
C 0.413919 -2.774992 -0.605826
C -2.767074 -1.409865 0.841130
C 2.010610 1.262410 -0.851466
C -4.061397 -0.809507 0.248056
C -4.216139 0.695700 0.543403
C 3.406773 1.002984 -0.292739
C 4.153975 2.052218 0.296231
C 3.999267 -0.281651 -0.395776
C -5.846469 1.196066 -1.244091
C -5.781291 2.566189 0.773018
C 5.468889 1.829028 0.767087
C 5.309921 -0.509932 0.076645
C 6.051818 0.545929 0.658513
H -0.569261 -0.950561 2.250052
H -2.125473 -0.556238 -1.637886
H -0.544073 -3.191643 1.317946
H 1.144087 -2.655388 1.460150
H -0.490338 -2.268052 -2.540686
H -1.637657 -2.925990 -1.355710
H 0.308702 1.038335 1.271212
H 1.667025 -0.131167 1.438145
H 0.107963 0.241893 -2.451650
H -0.691625 1.278694 -1.213226
H 1.341219 -2.277890 -0.936494
H 0.537132 -3.865128 -0.762503
H -2.759850 -2.507650 0.626331
H -2.801051 -1.308374 1.944845
H 1.644742 2.253849 -0.475765
H 2.073567 1.350225 -1.955787
H -4.926844 -1.343024 0.687214
H -4.096905 -1.000880 -0.842364
H -3.406674 1.264172 0.019558
H -4.059189 0.854209 1.628385
H 3.703723 3.048618 0.390214
H 3.413235 -1.094624 -0.839165
H -5.810789 0.162094 -1.626673
H -5.124047 1.813321 -1.840583
H -6.863019 1.587516 -1.428745
H -6.815428 2.897252 0.566910
H -5.083281 3.340736 0.360983
H -5.644409 2.534546 1.868863
H 6.033353 2.651437 1.221448
H 5.754865 -1.508221 -0.008857
H 7.069450 0.369192 1.025076


