%chk=000047469.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047469

0 1
 N    2.801200      -1.907700     -7.9999998E-04
 C    2.439800      0.2938000      1.9999999E-04
 C    1.809800     -0.9525000     -7.9999998E-04
 C    1.643600       1.456200      7.9999998E-04
 C  -0.3516000      7.2099999E-02 -8.9999998E-04
 C   0.4176000      -1.095000     -1.4000000E-03
 C   0.2497000       1.329000      5.0000002E-04
 C    3.842200      5.2800000E-02  6.0000003E-04
 C   -1.796100     -2.9800000E-02 -6.9999998E-04
 C    4.032900      -1.309800     -9.9999997E-05
 C    2.233500       2.831000      1.0000000E-03
 C   -2.489700     -8.0799997E-02   1.207700    
 C   -2.491400     -7.7299997E-02  -1.208300    
 C   -3.881000     -0.1794000       1.208500    
 C   -3.882800     -0.1759000      -1.207300    
 C   -4.577700     -0.2268000      1.0000000E-03
 H  -3.7700001E-02  -2.080900     -2.0000001E-03
 H  -0.3659000       2.227500      1.0000000E-03
 H    4.633400      0.7898000      1.3000000E-03
 H    2.641900      -2.905700     -1.3000000E-03
 H    4.934200      -1.906300     -9.9999997E-05
 H    1.911500       3.378900     -0.8908000    
 H    1.907600       3.380500      0.8906000    
 H    3.326900       2.814100      3.5999999E-03
 H   -1.962100     -4.4900000E-02   2.158000    
 H   -1.965200     -3.8800001E-02  -2.159200    
 H   -4.422200     -0.2191000       2.149400    
 H   -4.425300     -0.2129000      -2.147500    
 H   -5.661000     -0.3036000      1.7000000E-03


%chk=000047469-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000047469

0 1
N 2.853608 -1.945287 -0.000738
C 2.486603 0.312502 0.000004
C 1.842119 -0.976702 -0.000406
C 1.685967 1.491579 0.000437
C -0.346152 0.044651 0.000044
C 0.439368 -1.129867 -0.000373
C 0.283281 1.328383 0.000449
C 3.917547 0.070037 -0.000158
C -1.846505 -0.051489 0.000190
C 4.104936 -1.310056 -0.000589
C 2.309346 2.876792 0.000725
C -2.569676 -0.098441 1.221113
C -2.570304 -0.093862 -1.220511
C -3.980708 -0.187718 1.222415
C -3.981343 -0.183144 -1.221410
C -4.691631 -0.230662 0.000599
H -0.038181 -2.115807 -0.000683
H -0.357342 2.219086 0.000847
H 4.712543 0.813407 -0.000023
H 2.702008 -2.951288 -0.001021
H 5.027503 -1.887923 -0.000820
H 2.000480 3.454731 -0.890610
H 1.995069 3.456781 0.888795
H 3.411006 2.829335 0.004070
H -2.019874 -0.063541 2.168765
H -2.021014 -0.055450 -2.168325
H -4.522964 -0.223164 2.174420
H -4.524083 -0.215051 -2.173265
H -5.785506 -0.299333 0.000755


