%chk=000011978.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011978

0 1
 N    2.106900      0.8759000     -3.9999999E-04
 C   0.5069000     -0.6790000      1.9999999E-04
 C   0.7417000      0.6977000       0.000000    
 C   -1.869400     -0.2088000      6.0000003E-04
 C  -0.8245000      -1.140000      1.9999999E-04
 C  -0.2927000       1.640200     -9.9999997E-05
 C    1.777800      -1.319200      1.9999999E-04
 C   -1.605200       1.159500      5.0000002E-04
 C    2.741500     -0.3372000     -3.0000001E-04
 C   -3.283000     -0.6891000     -1.0000000E-03
 H   -1.031200      -2.206800     -1.9000000E-03
 H  -8.8000000E-02   2.705600     -8.9999998E-04
 H    1.968000      -2.383800      3.9999999E-04
 H    2.572300       1.772900     -6.9999998E-04
 H   -2.423500       1.876100     -1.7000000E-03
 H    3.820900     -0.3938000     -3.9999999E-04
 H   -3.372900      -1.656100      0.5056000    
 H   -3.938700      1.0900000E-02  0.5280000    
 H   -3.641300     -0.7973000      -1.029500    


%chk=000011978-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000011978

0 1
N 2.155213 0.911338 -0.022199
C 0.520048 -0.687152 0.030035
C 0.765309 0.730329 -0.024451
C -1.889080 -0.231617 -0.003347
C -0.823157 -1.153662 0.039899
C -0.288197 1.670506 -0.068497
C 1.812568 -1.341220 0.064126
C -1.604572 1.172367 -0.057271
C 2.784180 -0.341738 0.031196
C -3.335431 -0.702167 0.006759
H -1.031880 -2.229365 0.081075
H -0.097598 2.749036 -0.109959
H 2.002931 -2.412191 0.107753
H 2.631816 1.809366 -0.055321
H -2.443461 1.878710 -0.090865
H 3.869713 -0.423753 0.041610
H -3.401727 -1.803370 0.045824
H -3.884507 -0.302129 0.880565
H -3.876567 -0.365590 -0.898131


