%chk=000053337.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053337

0 1
 N   0.6171000     -1.1000000E-03 -0.4045000    
 N   -3.546600     -6.9999998E-04  7.6700002E-02
 C    3.342800     -4.1000000E-03  -1.365700    
 C    3.006800     -2.0000001E-03  9.0200000E-02
 C    4.886300     -5.9000002E-03  -1.587100    
 C    2.764600       1.256100      -2.079000    
 C    2.802400      -1.228000      -2.175000    
 C    1.672700     -8.9999998E-04  0.5166000    
 C    4.045400     -1.9000000E-03   1.021300    
 C  -0.7949000     -1.0000000E-03 -0.2414000    
 C    1.394200      1.9999999E-04   1.889000    
 C   -1.483600      -1.215600     -0.1606000    
 C   -1.483500       1.213700     -0.1628000    
 C    3.758400     -5.0000002E-04   2.386300    
 C   -2.878600      -1.168000      6.0000003E-04
 C   -2.878600       1.166300     -1.5000000E-03
 C    2.432700      5.0000002E-04   2.820200    
 C  -0.8171000      -2.451100     -0.2365000    
 C  -0.8170000       2.449000     -0.2409000    
 C   -3.569900      -2.373800      8.1600003E-02
 C   -3.569800       2.372400      7.7399999E-02
 C   -1.531400      -3.642500     -0.1526000    
 C   -1.531300       3.640500     -0.1593000    
 C   -2.910700      -3.603300      6.6999998E-03
 C   -2.910500       3.601800      9.9999997E-05
 H    5.363900     -0.9060000      -1.181800    
 H    5.366100      0.8883000      -1.171000    
 H    5.120200      3.8000001E-03  -2.659700    
 H    1.692200       1.269600      -2.268800    
 H    3.228700       1.373600      -3.067000    
 H    3.006300       2.162200      -1.509300    
 H    1.722500      -1.314500      -2.280300    
 H    3.144700      -2.159600      -1.707000    
 H    3.199500      -1.216800      -3.197900    
 H    5.099000     -3.8999999E-03  0.7708000    
 H   0.8320000     -5.2499998E-02  -1.382300    
 H   0.3720000      1.0000000E-03   2.258700    
 H    4.566000     -6.9999998E-04   3.112500    
 H    2.209500      1.4000000E-03   3.883100    
 H   0.2600000      -2.518300     -0.3643000    
 H   0.2601000       2.516000     -0.3683000    
 H   -4.651200      -2.369700      0.2066000    
 H   -4.651100       2.368500      0.2023000    
 H   -1.014500      -4.595300     -0.2123000    
 H   -1.014400       4.593200     -0.2207000    
 H   -3.477700      -4.527300      7.2999999E-02
 H   -3.477500       4.525800      6.4700000E-02


%chk=000053337-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000053337

0 1
N 0.649338 -0.429675 -0.285479
N -3.619511 0.029097 0.068456
C 3.422446 -0.078021 -1.464884
C 3.046800 0.198869 0.020871
C 4.913122 0.258048 -1.754584
C 2.568259 0.813840 -2.419510
C 3.247587 -1.591093 -1.821409
C 1.711959 0.053392 0.537408
C 4.037258 0.630866 0.942457
C -0.736745 -0.252038 -0.111473
C 1.428609 0.340952 1.900618
C -1.600425 -1.388175 -0.285790
C -1.329352 1.032488 0.139634
C 3.754549 0.930971 2.292801
C -3.042216 -1.180935 -0.215618
C -2.784249 1.102234 0.251912
C 2.435140 0.789165 2.773615
C -1.110848 -2.723504 -0.504681
C -0.578660 2.256913 0.223358
C -3.917509 -2.302659 -0.434847
C -3.400690 2.374143 0.527668
C -1.987937 -3.788269 -0.704573
C -1.213011 3.472692 0.466934
C -3.407362 -3.572866 -0.684743
C -2.637488 3.531462 0.640244
H 5.605588 -0.386491 -1.182483
H 5.146269 1.314079 -1.528309
H 5.116430 0.094738 -2.828515
H 1.484278 0.674944 -2.276967
H 2.811453 0.578619 -3.472760
H 2.795847 1.881599 -2.246987
H 2.196141 -1.932485 -1.865300
H 3.779168 -2.228870 -1.092537
H 3.669925 -1.786965 -2.824728
H 5.066885 0.751069 0.597342
H 0.911181 -1.156881 -0.950876
H 0.407877 0.196287 2.267971
H 4.557104 1.268218 2.957375
H 2.192628 1.007071 3.819350
H -0.033121 -2.924215 -0.475353
H 0.505842 2.233542 0.091077
H -4.993093 -2.106171 -0.389531
H -4.490576 2.382769 0.625369
H -1.595577 -4.799292 -0.859413
H -0.622190 4.393530 0.521896
H -4.085087 -4.417847 -0.848906
H -3.119840 4.493754 0.844701


