%chk=000124103.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124103

0 1
 O    2.643200      -2.199300     -7.9999998E-04
 O   -3.653700     -0.8051000      2.2000000E-03
 N   -1.990700      0.8644000     -5.0000002E-04
 C   0.4580000      0.7737000      9.9999997E-05
 C    1.634600     -1.2700000E-02   0.000000    
 C  -0.7939000      0.1371000     -3.0000001E-04
 C   0.2725000      -2.028800     -9.9999997E-05
 C    1.524500      -1.412900     -1.9999999E-04
 C  -0.8845000      -1.255200     -3.9999999E-04
 C   0.5678000       2.173800      9.9999997E-05
 C    2.886200      0.6241000      9.9999997E-05
 C   0.1514000      -3.517500      5.0000002E-04
 C    1.819700       2.789700      5.0000002E-04
 C    2.976700       2.016300      3.9999999E-04
 C   -3.298000      0.3690000     -7.9999998E-04
 C   -4.313900       1.483600     -8.9999998E-04
 H   -1.812700      -1.804500     -1.0000000E-03
 H  -0.2909000       2.837100     -1.9999999E-04
 H    3.821600      7.1900003E-02 -1.7000001E-02
 H   -1.916600       1.875300     -7.9999998E-04
 H   0.6258000      -3.937200     -0.8929000    
 H   0.6303000      -3.936900      0.8915000    
 H  -0.8924000      -3.849500      3.3000000E-03
 H    1.891800       3.873500     -3.0000001E-04
 H    3.950800       2.497000     -3.4000000E-03
 H    3.362200      -1.756900      0.4771000    
 H   -4.197400       2.090700      0.9013000    
 H   -5.323800       1.064300     -1.8700000E-02
 H   -4.176000       2.111800     -0.8854000    


%chk=000124103-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124103

0 1
O 2.677825 -2.298385 0.052279
O -3.728475 -0.760893 0.047582
N -2.033690 0.873779 0.008711
C 0.431353 0.772353 -0.003832
C 1.646766 -0.022494 0.007829
C -0.843741 0.088155 0.018992
C 0.300704 -2.105019 0.061190
C 1.545681 -1.458136 0.039813
C -0.884237 -1.315241 0.050528
C 0.564516 2.201491 -0.037494
C 2.914283 0.650206 -0.012969
C 0.224506 -3.616330 0.095457
C 1.812811 2.827113 -0.057731
C 3.004908 2.042012 -0.045042
C -3.365243 0.453177 0.022444
C -4.387148 1.590196 0.003661
H -1.857492 -1.809477 0.067012
H -0.321157 2.848381 -0.048937
H 3.851534 0.076651 -0.003432
H -1.900174 1.884321 -0.010585
H 0.747028 -4.060300 -0.771645
H 0.724044 -4.018832 0.995993
H -0.823067 -3.958714 0.090605
H 1.879084 3.919798 -0.083129
H 3.983779 2.532057 -0.060421
H 3.517388 -1.777955 0.028901
H -5.032416 1.506019 0.895100
H -5.036383 1.472923 -0.881170
H -3.940388 2.599944 -0.016309


