%chk=000001868.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001868

0 1
 O    3.846500      0.7268000      2.0500001E-02
 N   -1.028700      -1.795800     -2.8200001E-02
 N   -3.946100      0.5110000      0.3551000    
 C   -1.128200      0.4284000      1.2000001E-03
 C   -1.876700     -0.7280000     -1.1100000E-02
 C   -1.786500       1.764000      3.3300001E-02
 C   0.2416000      5.2200001E-02 -3.0000001E-04
 C   -3.361200     -0.7909000     -3.4400001E-02
 C   -3.282300       1.636000     -0.3367000    
 C   0.2765000      -1.347700     -2.0099999E-02
 C    1.460000      0.7601000      1.4600000E-02
 C    1.475200      -2.070300     -2.8500000E-02
 C    2.664800      4.8099998E-02  6.8000001E-03
 C    2.669900      -1.344900     -1.4900000E-02
 C    3.775200       2.150900      4.2599998E-02
 H   -1.692900       2.180100       1.043800    
 H   -1.293800       2.453900     -0.6604000    
 H   -3.701200      -1.058800      -1.041600    
 H   -3.722600      -1.558600      0.6577000    
 H   -3.793000       2.568300     -7.1099997E-02
 H   -3.392600       1.510800      -1.421700    
 H   -1.307500      -2.767400     -4.6100002E-02
 H   -4.939700      0.5100000      0.1262000    
 H    1.395500       1.841300      3.1199999E-02
 H    1.481500      -3.155100     -4.4399999E-02
 H    3.614700      -1.883600     -2.0800000E-02
 H    4.804100       2.525500      5.1300000E-02
 H    3.295800       2.516600      0.9570000    
 H    3.300700       2.545100     -0.8625000    


%chk=000001868-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000001868

0 1
O 3.918950 0.707090 0.012758
N -1.059584 -1.844999 -0.041787
N -3.970795 0.507411 0.322338
C -1.188680 0.436039 0.017719
C -1.928972 -0.744924 -0.007320
C -1.857947 1.788814 0.043776
C 0.211441 0.062267 0.006008
C -3.431621 -0.831195 -0.015093
C -3.331706 1.629980 -0.408300
C 0.264648 -1.375519 -0.035611
C 1.422605 0.809338 0.022627
C 1.489746 -2.076336 -0.060003
C 2.641896 0.101008 -0.001767
C 2.678322 -1.326207 -0.043242
C 3.960258 2.166421 0.065224
H -1.833807 2.219478 1.064553
H -1.342964 2.504238 -0.628073
H -3.775509 -1.205362 -1.015949
H -3.790620 -1.557695 0.742170
H -3.900044 2.550716 -0.183970
H -3.349019 1.480553 -1.517183
H -1.339036 -2.823058 -0.055034
H -4.995503 0.534040 0.273893
H 1.392411 1.902346 0.057053
H 1.528293 -3.170899 -0.090841
H 3.657474 -1.813842 -0.060591
H 5.029316 2.427279 0.073177
H 3.475823 2.552719 0.984338
H 3.473623 2.618299 -0.822372


