%chk=000128653.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128653

0 1
 O   -1.745100     -0.5301000       1.079800    
 O   -2.591700       2.313100     -0.9330000    
 O   -4.371900      0.5288000      0.1057000    
 O   -1.368000      -3.145700      0.1392000    
 O    4.415600       1.089900     -0.5105000    
 N  -0.1139000       1.136600      0.6557000    
 N   0.3609000       2.390300      0.4692000    
 N   0.9919000      -1.007600      0.3062000    
 N    3.314800     -0.9308000     -0.2909000    
 N    2.238800      -2.968300     -7.3799998E-02
 C   -1.522900      0.8381000      0.6925000    
 C   -2.140100      0.9963000     -0.6881000    
 C   -3.278700     -6.0000003E-04 -0.6440000    
 C   -2.670600      -1.143200      0.1565000    
 C   -1.897700      -2.135800     -0.7015000    
 C   0.9326000      0.2810000      0.3544000    
 C    2.139000       1.088400      4.0199999E-02
 C    1.695900       2.349500      0.1465000    
 C    3.401800      0.4438000     -0.2779000    
 C    2.209300      -1.593800     -2.6200000E-02
 H   -2.010400       1.482700       1.433600    
 H   -1.428600      0.7213000      -1.476500    
 H   -3.656900     -0.2844000      -1.629400    
 H   -3.415700      -1.672700      0.7611000    
 H   -1.068300      -1.664400      -1.235100    
 H   -2.562300      -2.607500      -1.432500    
 H  -6.9200002E-02   3.214100      0.8676000    
 H   -3.067700       2.305600      -1.780900    
 H   -4.080400      0.6929000       1.018000    
 H    2.240800       3.271600      2.3700001E-02
 H  -0.8978000      -3.776600     -0.4322000    
 H    1.410800      -3.518900      0.1254000    
 H    3.089600      -3.468100     -0.3080000    


%chk=000128653-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128653

0 1
O -2.301575 0.958890 0.985625
O -1.791059 -0.265882 -2.362482
O -4.224252 0.112924 -1.168392
O -1.918920 -0.603664 3.084481
O 4.574741 -0.226331 0.483874
N -0.032149 0.622953 0.340717
N 0.349305 0.570890 1.684292
N 1.034767 0.291522 -1.806270
N 3.488314 -0.110941 -1.610535
N 2.417023 -0.037869 -3.673577
C -1.412629 0.802773 -0.142023
C -1.839661 -0.474153 -0.934408
C -3.286019 -0.717220 -0.433205
C -3.207573 -0.227061 1.032842
C -2.628329 -1.300042 1.988760
C 1.066421 0.386032 -0.455154
C 2.195858 0.215025 0.418834
C 1.702711 0.309589 1.729321
C 3.519188 -0.054837 -0.200567
C 2.338285 0.049481 -2.302219
H -1.455652 1.705283 -0.777824
H -1.186819 -1.319248 -0.636337
H -3.567950 -1.788427 -0.504080
H -4.172925 0.159992 1.391452
H -1.915676 -1.966647 1.460727
H -3.458121 -1.915427 2.386813
H -0.411326 0.437047 2.381823
H -0.817973 -0.047580 -2.556007
H -3.857988 0.217577 -2.089188
H 2.224651 0.206762 2.677397
H -1.865781 -1.194486 3.875508
H 1.595152 0.114958 -4.250921
H 3.329863 -0.216384 -4.084475


