%chk=000005205.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005205

0 1
 N    3.298900      -1.043900      0.5113000    
 C   0.5152000      -1.127000     -9.7000003E-02
 C    1.140400      7.7399999E-02 -0.1140000    
 C    1.332500      -2.408000     -1.7400000E-02
 C    2.659100      0.1633000     -3.5399999E-02
 C    2.838700      -2.219100     -0.2261000    
 C  -0.9667000      -1.308100     -0.1224000    
 C   0.4437000       1.394200     -0.1696000    
 C   -1.820000     -0.5249000      0.6872000    
 C  -0.6778000       1.671200      0.6416000    
 C   -1.269700      0.6020000       1.527800    
 C    4.755300     -0.9275000      0.4517000    
 C   -1.549700      -2.294200     -0.9383000    
 C   0.9308000       2.411700      -1.009100    
 C   -3.207000     -0.7528000      0.6760000    
 C   -1.280200       2.939400      0.5953000    
 C   -2.929700      -2.510500     -0.9416000    
 C   0.3234000       3.668200      -1.046100    
 C   -3.757500      -1.744100     -0.1310000    
 C  -0.7798000       3.932700     -0.2429000    
 H    1.164000      -2.852000      0.9733000    
 H    1.003100      -3.145000     -0.7564000    
 H    3.051900      0.3788000      -1.038500    
 H    2.932300       1.003500      0.6165000    
 H    3.349600      -3.122500      0.1296000    
 H    3.060300      -2.124700      -1.298000    
 H   -2.059000       1.026600       2.161000    
 H  -0.5143000      0.2233000       2.228500    
 H    5.095300     -5.8200002E-02   1.025400    
 H    5.122900     -0.8283000     -0.5760000    
 H    5.229000      -1.806300      0.9033000    
 H  -0.9445000      -2.905800      -1.602600    
 H    1.788500       2.240500      -1.655500    
 H   -3.869000     -0.1488000       1.291800    
 H   -2.149900       3.158500       1.209900    
 H   -3.355600      -3.277700      -1.581900    
 H   0.7141000       4.439500      -1.703600    
 H   -4.830500      -1.910500     -0.1345000    
 H   -1.253500       4.909400     -0.2722000    


%chk=000005205-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000005205

0 1
N 3.339178 -1.065366 0.443946
C 0.508031 -1.146610 -0.011068
C 1.141519 0.081292 -0.017543
C 1.337546 -2.430999 0.041472
C 2.669702 0.177453 0.023460
C 2.816090 -2.219044 -0.312829
C -0.973754 -1.328867 -0.067136
C 0.450974 1.398817 -0.116223
C -1.865369 -0.508253 0.695243
C -0.720805 1.691095 0.649614
C -1.297007 0.611179 1.551941
C 4.806438 -0.944112 0.389444
C -1.542803 -2.357485 -0.873178
C 0.985435 2.428522 -0.944282
C -3.261991 -0.725264 0.625241
C -1.332946 2.962600 0.547452
C -2.935066 -2.563876 -0.939262
C 0.370457 3.693228 -1.036758
C -3.805439 -1.747275 -0.181487
C -0.797415 3.966410 -0.287831
H 1.264750 -2.853507 1.063526
H 0.912718 -3.193698 -0.636784
H 3.036463 0.501646 -0.990964
H 2.956016 0.984662 0.725017
H 3.401099 -3.117796 -0.043967
H 2.923656 -2.068337 -1.419884
H -2.080385 1.032184 2.205704
H -0.492125 0.207856 2.198944
H 5.134633 -0.102258 1.025429
H 5.199281 -0.766414 -0.644886
H 5.270136 -1.867714 0.778819
H -0.890815 -2.988485 -1.486462
H 1.879353 2.229132 -1.545394
H -3.927364 -0.085289 1.217365
H -2.233944 3.166500 1.138755
H -3.339199 -3.354492 -1.581261
H 0.796303 4.460181 -1.693384
H -4.888904 -1.905385 -0.219429
H -1.279848 4.948068 -0.351257


