%chk=000090731.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090731

0 1
 O   7.3100001E-02  0.7436000       1.760000    
 N    1.383500       3.182600       1.067600    
 C  -9.6100003E-02   1.749300     -0.4233000    
 C  -8.9999996E-03  0.3713000      0.3698000    
 C   -1.384200       2.540500     -4.4399999E-02
 C    1.181500       2.629000     -0.2662000    
 C   -1.230400     -0.5443000      0.1522000    
 C    1.258600     -0.4477000      4.5299999E-02
 C   -1.546100       3.854500     -0.7992000    
 C   -1.679500      -1.286800       1.212900    
 C    1.725100     -0.4317000      -1.242300    
 C   -1.806800     -0.5699000      -1.090900    
 C    1.852300      -1.148100       1.061500    
 C   -2.784600      -2.114900       1.016300    
 C    2.870500      -1.171500      -1.535700    
 C   -2.911900      -1.398000      -1.287300    
 C    2.997900      -1.887800      0.7681000    
 C   -3.400900      -2.170500     -0.2337000    
 C    3.506900      -1.899500     -0.5306000    
 H  -0.1697000       1.560300      -1.500100    
 H   -2.273900       1.939100     -0.2545000    
 H   -1.407300       2.748600       1.031500    
 H    2.081100       2.071700     -0.5380000    
 H    1.137700       3.459100     -0.9807000    
 H   -1.471800       3.698400      -1.880000    
 H   -2.530400       4.285600     -0.5884000    
 H  -0.7984000       4.593800     -0.4997000    
 H   0.9074000       1.220900       1.906100    
 H   -1.212700      -1.268700       2.191700    
 H    1.243400      0.1002000      -2.053100    
 H   -1.441500     -6.6999998E-03  -1.940200    
 H    1.471300      -1.170900       2.076700    
 H   0.6136000       3.804500       1.308000    
 H    2.223500       3.759900       1.069800    
 H   -3.164000      -2.718400       1.835700    
 H    3.263800      -1.185900      -2.548100    
 H   -3.388300      -1.446500      -2.262200    
 H    3.491500      -2.458000       1.549600    
 H   -4.260100      -2.816700     -0.3874000    
 H    4.397600      -2.477300     -0.7594000    


%chk=000090731-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000090731

0 1
O 0.149569 0.699811 1.821784
N 1.287816 3.036686 1.302071
C -0.093748 1.775515 -0.386466
C 0.059170 0.403922 0.388156
C -1.420194 2.493197 -0.012800
C 1.151948 2.673917 -0.149520
C -1.182014 -0.494907 0.175177
C 1.324516 -0.383791 -0.058495
C -1.647980 3.827780 -0.756471
C -1.996031 -0.850286 1.277166
C 1.795329 -0.411357 -1.397367
C -1.530581 -0.972184 -1.114085
C 2.016631 -1.150317 0.913151
C -3.138031 -1.663355 1.093904
C 2.926090 -1.181175 -1.754036
C -2.675985 -1.776617 -1.300214
C 3.142370 -1.925365 0.559036
C -3.486745 -2.127090 -0.195025
C 3.604639 -1.944806 -0.777672
H -0.130269 1.564126 -1.474580
H -2.258843 1.810933 -0.241798
H -1.458351 2.650344 1.082772
H 2.061292 2.115600 -0.432105
H 1.100518 3.570100 -0.801076
H -1.598549 3.689122 -1.853571
H -2.646169 4.237600 -0.516775
H -0.903435 4.600514 -0.485552
H 0.690068 1.579810 1.881087
H -1.713823 -0.476443 2.264853
H 1.291708 0.171969 -2.177633
H -0.902598 -0.734105 -1.980379
H 1.653432 -1.116554 1.944783
H 0.639008 3.781873 1.586295
H 2.249824 3.288321 1.558060
H -3.756511 -1.932868 1.958237
H 3.274633 -1.184746 -2.793505
H -2.930870 -2.136243 -2.303949
H 3.659032 -2.515232 1.325289
H -4.373321 -2.755712 -0.337379
H 4.479160 -2.544887 -1.053966


