%chk=000154334.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154334

0 1
 O  -0.8317000       1.413600      5.2600000E-02
 O   -2.907800     -0.5496000      -1.219700    
 O   -2.879400      0.9308000      -1.216300    
 N    2.027900       1.573300      1.6899999E-02
 C   -2.232600     -0.5986000      5.7999998E-02
 C   -2.217900      0.9435000      6.9399998E-02
 C  -0.7245000     -0.9063000      3.5999998E-02
 C   8.5000005E-03  0.2992000      3.5399999E-02
 C   -3.027500      -1.347000       1.087900    
 C   -3.033100       1.690800       1.088200    
 C  -2.5300000E-02  -2.100300      1.7500000E-02
 C    1.388700      0.3852000      1.7200001E-02
 C    2.078700     -0.8433000     -1.1000000E-03
 C    1.371700      -2.068300     -7.9999998E-04
 C    3.479300     -0.8027000     -1.9700000E-02
 C    3.379700       1.564300     -1.5000000E-03
 C    4.145400      0.4155000     -1.9900000E-02
 H   -3.013600      -2.424900      0.8922000    
 H   -2.632600      -1.187000       2.097200    
 H   -4.078600      -1.038800       1.091500    
 H   -4.082600       1.378500       1.082400    
 H   -2.641000       1.534900       2.098700    
 H   -3.013100       2.767500      0.8877000    
 H  -0.5491000      -3.050700      1.5500000E-02
 H    1.914300      -3.011900     -1.5600000E-02
 H    4.060500      -1.722000     -3.4200002E-02
 H    3.846500       2.543800     -8.9999998E-04
 H    5.228000      0.4618000     -3.4200002E-02


%chk=000154334-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154334

0 1
O -0.855799 1.450592 0.243374
O -2.825289 -0.614596 -1.240107
O -2.741191 0.962063 -1.253694
N 2.048303 1.614134 0.076209
C -2.200563 -0.612529 0.168734
C -2.250860 0.958323 0.164790
C -0.718280 -0.895744 0.118134
C -0.023247 0.321605 0.123771
C -3.053961 -1.442512 1.110569
C -3.116289 1.810060 1.060521
C -0.021128 -2.131565 0.052351
C 1.401532 0.388894 0.060865
C 2.101203 -0.885051 -0.015436
C 1.375807 -2.123029 -0.017964
C 3.532658 -0.830116 -0.085836
C 3.393102 1.602272 0.008593
C 4.179312 0.406461 -0.075197
H -3.042971 -2.502561 0.798196
H -2.666424 -1.389044 2.143542
H -4.100428 -1.096063 1.096341
H -4.164176 1.472082 1.014063
H -2.758895 1.772766 2.103394
H -3.070760 2.858320 0.717907
H -0.573500 -3.077163 0.042727
H 1.933957 -3.064027 -0.080003
H 4.102869 -1.764175 -0.147449
H 3.883836 2.582789 0.020759
H 5.269985 0.479115 -0.128755


