%chk=000048866.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048866

0 1
 N    3.905900      0.4706000      0.1270000    
 N   0.2449000     -0.1021000     -0.1153000    
 N   -2.003100     -0.9263000     -0.2190000    
 N  -0.1842000      -2.397500      0.2279000    
 N   -3.041700       2.564800      0.3721000    
 N   -1.933700      -4.144700      0.6167000    
 C    2.497500      0.7927000     -6.3199997E-02
 C    4.342700     -0.5315000     -0.8472000    
 C    4.730400       1.675900      1.8700000E-02
 C    1.646100     -0.4638000      5.0500002E-02
 C    5.791900     -0.9256000     -0.6172000    
 C    4.294900       2.730900       1.021300    
 C  -0.6355000      -1.050400     -2.7000001E-02
 C   -2.819200      0.2258000     -0.1649000    
 C   -4.143200      0.1755000     -0.5720000    
 C   -2.315800       1.426900      0.2948000    
 C   -4.922000       1.325500     -0.5074000    
 C   -4.329300       2.484200     -3.2099999E-02
 C   -1.126500      -3.330800      0.4365000    
 H    2.320500       1.277100      -1.033100    
 H    2.135800       1.479400      0.7102000    
 H    3.798100      -1.471300     -0.7262000    
 H    4.205000     -0.1920000      -1.881300    
 H    5.774400       1.451700      0.2602000    
 H    4.707000       2.098700     -0.9936000    
 H    1.887000      -1.166900     -0.7514000    
 H    1.822000     -0.9249000       1.030700    
 H    6.493100     -0.1555000     -0.9532000    
 H    5.989600      -1.152600      0.4361000    
 H    6.023400      -1.828500      -1.193800    
 H    3.365700       3.229600      0.7282000    
 H    4.175400       2.313000       2.026900    
 H    5.059800       3.513500       1.083900    
 H   -2.533100      -1.757400     -0.4649000    
 H   0.8002000      -2.610900      0.3307000    
 H   -4.582200     -0.7474000     -0.9410000    
 H   -1.305300       1.552400      0.6617000    
 H   -5.960000       1.315300     -0.8192000    
 H   -4.893700       3.408200      3.7999999E-02


%chk=000048866-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000048866

0 1
N 3.896127 0.600151 -0.129840
N 0.193337 -0.148895 0.014170
N -2.071216 -0.874101 0.231702
N -0.336172 -2.349434 0.872013
N -2.921652 2.506854 -1.178859
N -2.033692 -4.137445 1.519819
C 2.436127 0.850931 -0.184894
C 4.433743 0.077312 -1.416057
C 4.674143 1.747670 0.410150
C 1.636687 -0.422741 0.163923
C 5.710779 -0.766332 -1.240601
C 4.533772 1.895989 1.936975
C -0.692035 -1.041035 0.341132
C -2.790222 0.247672 -0.247792
C -4.209881 0.162966 -0.253396
C -2.188360 1.449989 -0.723911
C -4.963264 1.254833 -0.722903
C -4.282075 2.408706 -1.177329
C -1.213286 -3.310669 1.222488
H 2.100943 1.218489 -1.182709
H 2.164020 1.634027 0.544206
H 3.651803 -0.558779 -1.873064
H 4.624345 0.906508 -2.143646
H 5.739122 1.575049 0.170794
H 4.388515 2.706396 -0.091493
H 1.962871 -1.247162 -0.510893
H 1.913628 -0.715373 1.202558
H 6.539918 -0.176406 -0.809916
H 5.515429 -1.617812 -0.565330
H 6.052486 -1.157583 -2.217157
H 3.485162 2.074226 2.237939
H 4.881908 0.977687 2.441315
H 5.134481 2.750860 2.299998
H -2.647929 -1.663845 0.537468
H 0.664267 -2.523026 0.986924
H -4.712190 -0.744835 0.104881
H -1.101799 1.546159 -0.731336
H -6.056941 1.214008 -0.737282
H -4.830097 3.280591 -1.550949


