%chk=000069162.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069162

0 1
 O    2.780200       1.905700      2.4000001E-03
 O   -1.384900      -2.942200      7.9999998E-04
 O   0.7620000      -2.483800     -6.0000003E-04
 N    1.628600     -0.1507000     -6.0000003E-04
 N  -0.4376000      -2.121600      1.9999999E-04
 C   0.2817000      0.2254000     -7.9999998E-04
 C  -0.7349000     -0.7297000      9.9999997E-05
 C   -2.389000       1.031200      1.9999999E-04
 C   -2.070200     -0.3268000      6.0000003E-04
 C  -3.7000000E-02   1.583400     -1.0000000E-03
 C   -1.372300       1.986200     -6.9999998E-04
 C   -3.816600       1.462700      1.9999999E-04
 C    2.755300      0.6793000     -5.0000002E-04
 C    4.034700     -0.1191000     -1.9999999E-04
 H   -2.883900      -1.048600      3.1000001E-03
 H   0.6853000       2.386400     -1.5000000E-03
 H   -1.608500       3.047200      8.9999998E-04
 H    1.827400      -1.144700     -6.0000003E-04
 H   -4.425700      0.7986000     -0.6224000    
 H   -4.212200       1.452000       1.020700    
 H   -3.928800       2.474000     -0.4053000    
 H    4.086700     -0.7341000      0.9026000    
 H    4.893700      0.5575000     -1.9200001E-02
 H    4.071100     -0.7625000     -0.8838000    


%chk=000069162-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000069162

0 1
O 2.820256 1.937896 0.070200
O -1.465350 -2.963204 -0.122377
O 0.772772 -2.583231 -0.092837
N 1.682630 -0.127990 -0.003998
N -0.468233 -2.148513 -0.087084
C 0.336841 0.270316 0.000166
C -0.723076 -0.704278 -0.039498
C -2.455833 1.041514 0.006681
C -2.088028 -0.311919 -0.036006
C -0.053321 1.642883 0.042422
C -1.406697 2.006889 0.045100
C -3.910071 1.470837 0.014044
C 2.836813 0.674718 0.030137
C 4.126901 -0.138182 0.018585
H -2.842460 -1.102523 -0.067873
H 0.735119 2.396651 0.071684
H -1.663501 3.072725 0.077968
H 1.794582 -1.158992 -0.036789
H -4.589681 0.605344 -0.056352
H -4.159324 2.021210 0.940674
H -4.132027 2.145517 -0.833634
H 4.200868 -0.773285 0.920556
H 4.981421 0.552803 -0.002804
H 4.174499 -0.801386 -0.864364


