%chk=000169987.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169987

0 1
 O    4.593800     -0.3904000     -1.9700000E-02
 O   -4.835300     -0.8282000      8.0000004E-03
 O   0.4577000       2.601600     -3.3500001E-02
 O    7.633800      -2.118800      1.5100000E-02
 O    5.555900      -2.823300     -5.6400001E-02
 O   -8.332300     -0.8494000      1.4700000E-02
 O   -6.863600      -2.481000      2.5000000E-02
 N  -0.4185000      0.4537000     -1.0500000E-02
 N    6.391600      -1.872900     -1.0900000E-02
 N   -7.128400      -1.242400      1.5400000E-02
 N   -1.698000      0.8960000     -1.2900000E-02
 C    4.379200      0.9407000      8.8999998E-03
 C    5.546400       1.643900      5.6600001E-02
 C   -4.007700      0.2320000     -2.3000001E-03
 C    5.942700     -0.5510000      1.0900000E-02
 C    6.573600      0.6703000      5.8300000E-02
 C   -4.672300       1.413500     -1.1300000E-02
 C    3.052600       1.484100     -1.1700000E-02
 C   -6.090700     -0.3083000      5.2999998E-03
 C   -6.044400       1.066300     -6.5000001E-03
 C    1.943100      0.7300000     -1.8999999E-02
 C   -2.581900     -4.9400002E-02 -2.0000001E-03
 C   0.6029000       1.383400     -2.1500001E-02
 H    5.664800       2.718100      8.6900003E-02
 H    7.639900      0.8444000      9.0200000E-02
 H   -4.249000       2.407700     -2.0300001E-02
 H    2.973000       2.568500     -1.0800000E-02
 H   -6.889700       1.740100     -1.0900000E-02
 H    1.985900     -0.3545000     -1.5200000E-02
 H   -2.295800      -1.117700      7.7000000E-03
 H  -0.2587000     -0.5494000     -1.1000000E-03


%chk=000169987-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169987

0 1
O 4.664738 -0.360985 0.009268
O -4.969499 -0.896610 -0.007978
O 0.395414 2.557959 0.012446
O 7.866072 -1.965272 0.008891
O 5.740438 -2.849211 0.003325
O -8.534561 -0.537849 -0.011353
O -7.214041 -2.424596 -0.016864
N -0.417610 0.343850 0.002609
N 6.571971 -1.860797 0.007404
N -7.383938 -1.143142 -0.012078
N -1.728910 0.730849 0.002454
C 4.438553 1.038094 0.013180
C 5.675993 1.702144 0.017159
C -4.040221 0.167017 -0.002638
C 6.051113 -0.521028 0.010781
C 6.705036 0.708117 0.015459
C -4.724280 1.393650 0.001244
C 3.080813 1.509624 0.012502
C -6.230260 -0.292409 -0.007301
C -6.121732 1.098096 -0.001822
C 1.970650 0.706221 0.007817
C -2.651332 -0.216990 -0.002343
C 0.617796 1.318488 0.007531
H 5.811365 2.781832 0.020639
H 7.782066 0.852011 0.017477
H -4.247080 2.370583 0.005675
H 2.932482 2.596870 0.016013
H -6.956061 1.794456 -0.000243
H 2.081246 -0.385704 0.004259
H -2.438001 -1.301774 -0.006253
H -0.157618 -0.655892 -0.000758


