%chk=000169159.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169159

0 1
 O  -0.8813000       2.487300     -6.9999998E-04
 O   -4.949600      0.8334000      4.9999999E-03
 O    4.372300       1.836700     -6.0000003E-04
 O    4.141200      -2.914000      3.8000001E-03
 N   -2.642300      0.9431000     -1.9999999E-04
 N    2.049100       1.626000       0.000000    
 C   -1.437900      0.2855000     -2.0000001E-03
 C  -0.4020000       1.194400     -1.7000000E-03
 C   0.9149000      0.7495000     -1.3000000E-03
 C   -1.307800      -1.081400     -2.4999999E-03
 C    1.117500     -0.6585000     -1.7000000E-03
 C   -2.332000       2.362000      1.9999999E-04
 C   2.7999999E-03  -1.552500     -2.6000000E-03
 C   -2.558400      -1.862600     -1.4000000E-03
 C    2.498600      -1.185500      3.0000001E-04
 C   -3.848200      0.2915000      2.3000001E-03
 C   -3.740800      -1.210200      1.4000000E-03
 C    3.356100       1.140300     -9.9999997E-05
 C    3.528200     -0.3302000      1.2000001E-03
 C   -2.479900      -3.359100     -2.4000001E-03
 C    2.748600      -2.667300      2.2000000E-03
 C    1.850800       3.071500      7.9999998E-04
 H   -2.747500       2.833700     -0.8963000    
 H   -2.746400       2.833000      0.8975000    
 H   0.1682000      -2.626800     -2.6000000E-03
 H   -4.682000      -1.751500      2.7000001E-03
 H    4.564100     -0.6536000      2.7000001E-03
 H   -1.953100      -3.720600      0.8871000    
 H   -1.955200      -3.719500     -0.8936000    
 H   -3.474300      -3.819100     -1.6000000E-03
 H    2.324100      -3.133800     -0.8928000    
 H    2.322300      -3.131700      0.8975000    
 H    1.309300       3.367200     -0.9027000    
 H    2.805000       3.606700      1.8000000E-03
 H    1.308100       3.366200      0.9039000    
 H    4.262800      -3.878800      4.9999999E-03


%chk=000169159-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169159

0 1
O -0.922858 2.527266 0.000301
O -4.997659 0.923048 -0.000306
O 4.383758 1.951142 0.001197
O 4.206565 -2.924186 0.000656
N -2.658233 0.944491 -0.000472
N 2.055943 1.616197 0.000894
C -1.441255 0.278711 -0.000215
C -0.389039 1.199810 0.000185
C 0.951992 0.755289 0.000494
C -1.305979 -1.124417 -0.000176
C 1.138416 -0.696858 0.000403
C -2.417590 2.407501 -0.000272
C 0.033739 -1.591049 0.000102
C -2.554898 -1.884648 -0.000314
C 2.512898 -1.192305 0.000604
C -3.902869 0.274408 -0.000370
C -3.761107 -1.194545 -0.000390
C 3.407268 1.135014 0.001236
C 3.570864 -0.315558 0.000934
C -2.510942 -3.397023 -0.000269
C 2.763899 -2.689625 0.000404
C 1.871843 3.089255 0.000947
H -2.816443 2.890406 -0.909174
H -2.817183 2.890292 0.908363
H 0.219206 -2.668687 0.000133
H -4.712431 -1.735350 -0.000428
H 4.596062 -0.688160 0.001019
H -1.975237 -3.778190 0.890121
H -1.974672 -3.778243 -0.890291
H -3.524360 -3.828919 -0.000573
H 2.288097 -3.140349 -0.899437
H 2.287730 -3.140678 0.899889
H 1.317502 3.410598 -0.895127
H 2.878532 3.532808 0.001456
H 1.316631 3.410410 0.896541
H 4.387110 -3.896557 0.000535


