%chk=000014390.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014390

0 1
 O   0.4180000     -0.3594000       2.249200    
 N   -3.146600      -2.112200     -0.8221000    
 C   0.3801000     -0.2005000      0.8101000    
 C  -0.5837000      -1.304300      0.3267000    
 C  -0.2682000       1.167300      0.5393000    
 C    1.807800     -0.4955000      0.3043000    
 C  -0.2955000       1.764800     -0.7343000    
 C    2.486700      0.1415000     -0.7548000    
 C   0.4444000       1.174300      -1.898900    
 C    1.937500       1.237900      -1.633800    
 C   -1.892100      -1.239700       1.094400    
 C   -2.850700      -2.317400      0.5909000    
 C  -0.9707000       1.832100       1.573600    
 C    2.497500      -1.555700      0.9587000    
 C  -0.9838000       2.979200     -0.9379000    
 C    3.822200     -0.2341000      -1.049000    
 C   -1.645600       3.037200       1.362700    
 C    3.803300      -1.927100      0.6377000    
 C   -1.652900       3.612200      0.1032000    
 C    4.474300      -1.253600     -0.3639000    
 C   -3.737500     -0.7903000      -1.038300    
 C   -4.044500      -3.156700      -1.317900    
 H  -0.7402000      -1.235200     -0.7531000    
 H  -0.1461000      -2.296300      0.5046000    
 H   -1.716100      -1.450500       2.157000    
 H   -2.383200     -0.2665000       1.065900    
 H   0.1020000      0.1599000      -2.122000    
 H   0.2296000       1.759100      -2.802800    
 H    2.229000       2.207400      -1.208600    
 H    2.426000       1.168600      -2.615700    
 H   -2.389000      -3.302100      0.7381000    
 H   -3.765600      -2.299100       1.197700    
 H   -1.020600       1.418800       2.578500    
 H    2.010200      -2.118200       1.754400    
 H    1.178400      0.1422000       2.591700    
 H  -0.9937000       3.446200      -1.920400    
 H    4.366300      0.2740000      -1.844100    
 H   -2.170000       3.515900       2.184400    
 H    4.287700      -2.736300       1.175400    
 H   -2.176200       4.547200     -7.0500001E-02
 H    5.493500      -1.522600     -0.6219000    
 H   -4.588700     -0.5979000     -0.3750000    
 H   -4.097200     -0.7003000      -2.070800    
 H   -3.005500      1.4800000E-02 -0.9294000    
 H   -5.013800      -3.146000     -0.8062000    
 H   -3.594000      -4.146600      -1.183700    
 H   -4.219400      -3.036800      -2.392900    


%chk=000014390-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014390

0 1
O 0.489758 -0.332192 2.403797
N -3.154413 -2.130831 -0.905442
C 0.398943 -0.140506 0.925327
C -0.602729 -1.253729 0.480304
C -0.199623 1.265861 0.656850
C 1.811437 -0.464277 0.339774
C -0.339733 1.812883 -0.652971
C 2.432161 0.092386 -0.821924
C 0.292348 1.157985 -1.866846
C 1.833860 1.151077 -1.746198
C -1.994737 -1.182339 1.139244
C -2.951840 -2.247281 0.561790
C -0.752853 1.985060 1.748383
C 2.515296 -1.487621 1.044568
C -1.010988 3.050459 -0.821882
C 3.730360 -0.365913 -1.186764
C -1.407330 3.223609 1.570194
C 3.795715 -1.929927 0.665121
C -1.544416 3.762793 0.273799
C 4.421195 -1.353433 -0.461793
C -3.852640 -0.889988 -1.298252
C -3.810457 -3.328637 -1.466064
H -0.724656 -1.230830 -0.616383
H -0.133527 -2.226598 0.723051
H -1.897643 -1.347532 2.228238
H -2.429971 -0.173710 1.016289
H -0.067996 0.123965 -2.020998
H 0.009526 1.728937 -2.770362
H 2.159826 2.159734 -1.419126
H 2.268426 0.998953 -2.752645
H -2.530795 -3.253884 0.755824
H -3.929409 -2.193093 1.110732
H -0.689103 1.545214 2.747102
H 2.029663 -1.934163 1.917448
H 1.242597 0.223258 2.735565
H -1.107436 3.461214 -1.834656
H 4.200428 0.070135 -2.077537
H -1.816879 3.752612 2.438175
H 4.295941 -2.716715 1.240750
H -2.057711 4.718082 0.116383
H 5.419224 -1.676642 -0.778080
H -4.878142 -0.803839 -0.854058
H -3.953084 -0.857112 -2.398240
H -3.272003 -0.004678 -0.987233
H -4.847947 -3.493086 -1.075023
H -3.211317 -4.226373 -1.229808
H -3.873925 -3.239590 -2.565922


