%chk=000171786.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171786

1 1
 O    6.070400      -1.012800      -1.217000    
 O    6.253600      -1.035500       1.048400    
 N  -0.8228000      -1.137700      9.1000004E-03
 N   0.4036000       4.791100      9.9999997E-05
 N   -4.959200      -3.565200     -5.7999999E-03
 C  -6.9899999E-02 -3.5200000E-02  1.0400000E-02
 C  -0.6524000       1.225700      4.1000000E-03
 C   -2.062500       1.329000     -3.7000000E-03
 C   -2.166100      -1.117600      1.8000000E-03
 C   -2.842600      0.1255000     -4.9999999E-03
 C    1.363900     -0.2631000      1.7600000E-02
 C   0.1547000       2.375200      5.5999998E-03
 C   -2.866800      -2.333300      1.1000000E-03
 C   -2.607900       2.636300     -9.8000001E-03
 C   -4.257900      7.4299999E-02 -1.2500000E-02
 C  -0.1270000      -2.445300      1.7000001E-02
 C  -0.4161000       3.644300     -6.0000003E-04
 C   -4.257200      -2.342500     -6.3999998E-03
 C   -1.797500       3.775100     -8.1000002E-03
 C   -4.952600      -1.139900     -1.3200000E-02
 C    2.042400     -0.3683000       1.228900    
 C    2.053400     -0.3747000      -1.187000    
 C    3.420100     -0.5868000       1.235700    
 C    3.431000     -0.5933000      -1.180200    
 C    4.114400     -0.6992000      3.1099999E-02
 C    5.550800     -0.9265000      3.8300000E-02
 H    1.240700       2.310100      1.1300000E-02
 H   -2.375100      -3.300700      6.3000000E-03
 H   -3.683300       2.794800     -1.5799999E-02
 H   -4.851800      0.9848000     -1.7899999E-02
 H   0.9576000      -2.454400      2.3900000E-02
 H  -0.4358000      -2.979300      0.9227000    
 H  -0.4248000      -2.984400     -0.8893000    
 H   -2.263300       4.757300     -1.3000000E-02
 H   -6.039700      -1.127300     -1.8900000E-02
 H    1.514800     -0.2832000       2.175800    
 H    1.533900     -0.2946000      -2.138900    
 H    3.934000     -0.6665000       2.190000    
 H    3.932000     -0.6746000      -2.140700    
 H    1.410300       4.694600      6.3000000E-03
 H  -1.4200000E-02   5.712100     -3.7000000E-03
 H   -5.970500      -3.568000     -1.3000000E-02
 H   -4.453000      -4.440700     -2.4999999E-03
 H    7.039200      -1.166600      -1.201200    


%chk=000171786-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171786

1 1
O 6.318286 -0.757329 -1.212519
O 6.425023 -0.737003 1.112229
N -0.847605 -1.293777 0.002715
N 0.437789 4.728101 -0.004146
N -5.238354 -3.476155 0.007529
C -0.051147 -0.175287 -0.000282
C -0.629955 1.138167 -0.002507
C -2.072259 1.269974 -0.002836
C -2.268680 -1.219841 0.002044
C -2.887988 0.081049 -0.001005
C 1.438991 -0.338771 0.001224
C 0.209734 2.294149 -0.003728
C -3.045531 -2.405045 0.004797
C -2.609541 2.596288 -0.004547
C -4.320495 0.115022 -0.001415
C -0.233422 -2.651787 0.008221
C -0.346211 3.589371 -0.004334
C -4.459730 -2.335986 0.004610
C -1.783772 3.714751 -0.005184
C -5.087707 -1.041394 0.001248
C 2.148979 -0.378012 1.230572
C 2.150586 -0.400055 -1.225506
C 3.552387 -0.496805 1.230944
C 3.555644 -0.519324 -1.224712
C 4.259370 -0.569948 0.004240
C 5.748340 -0.695020 0.060515
H 1.295976 2.167522 -0.003422
H -2.575191 -3.389868 0.007293
H -3.691172 2.751938 -0.004965
H -4.835866 1.078496 -0.003810
H 0.858286 -2.565748 0.010227
H -0.551442 -3.199449 0.910666
H -0.547849 -3.205503 -0.891806
H -2.229074 4.716571 -0.006093
H -6.181131 -0.973996 0.000953
H 1.605129 -0.312590 2.179103
H 1.607391 -0.351369 -2.175514
H 4.118144 -0.531848 2.167479
H 4.113462 -0.570912 -2.163421
H 1.453264 4.670450 -0.001193
H 0.019059 5.654888 -0.003388
H -6.253927 -3.415545 0.007753
H -4.823878 -4.405285 0.010670
H 7.306890 -0.840083 -1.137395


