%chk=000138707.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000138707

0 1
 O   -1.076600       1.437900     -0.3925000    
 O    1.143200       1.488200      0.5051000    
 O    1.698300      -1.833800      0.7599000    
 O    3.862300       2.134800      0.3322000    
 O    3.428600     -0.3981000      -2.404500    
 O   -1.625300      -1.896400     -0.3272000    
 O   -3.784600       2.078800     -0.7164000    
 O   -3.805500     -0.1039000       2.338000    
 O    3.143000     -0.8640000       2.096400    
 O    5.114500      0.3931000      0.7878000    
 O    4.147900      -1.883500     -0.9593000    
 O   -2.836200      -1.104800      -1.976600    
 O   -4.971300      0.2857000      -1.147500    
 O   -4.310700      -1.757400      0.9876000    
 N    2.548800     -0.9689000       1.013400    
 N    4.072600      0.9129000      0.3656000    
 N    3.568100     -0.8285000      -1.249600    
 N   -2.416900      -1.074500     -0.8103000    
 N   -4.000900      0.8602000     -0.6352000    
 N   -3.770500     -0.6708000       1.235200    
 C   -2.983400      3.3000000E-03  0.1121000    
 C    2.958400     -1.5900001E-02 -0.1079000    
 C   -1.811800      0.8234000      0.6628000    
 C    1.710000      0.7455000     -0.5663000    
 C  -1.8000000E-03   2.236800      9.7099997E-02
 H   -1.132300      0.1876000       1.245900    
 H   -2.177700       1.609700       1.336600    
 H   0.9615000      4.4900000E-02 -0.9592000    
 H    1.958600       1.441000      -1.379200    
 H   0.2933000       2.927100     -0.7011000    
 H  -0.3326000       2.852000      0.9414000    


%chk=000138707-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000138707

0 1
O -1.148924 1.673692 -0.418893
O 1.136350 1.696282 0.356182
O 1.116832 -1.092656 1.407484
O 4.107425 1.957179 -0.138761
O 3.074488 -1.129591 -2.109121
O -1.159146 -1.172068 -1.287623
O -4.118723 1.996703 0.060743
O -3.112578 -0.965503 2.228408
O 2.945813 -0.167627 2.422605
O 5.090474 -0.013897 0.486795
O 3.225885 -2.417106 -0.216886
O -2.985082 -0.301444 -2.355147
O -5.122248 -0.003018 -0.425933
O -3.272008 -2.372267 0.423733
N 2.236005 -0.471973 1.417355
N 4.103625 0.709127 0.123802
N 3.027457 -1.329629 -0.842826
N -2.273652 -0.544972 -1.334495
N -4.127347 0.733711 -0.116471
N -3.066491 -1.247748 0.977823
C -2.752160 -0.014985 0.067634
C 2.722208 -0.037875 -0.014607
C -1.665250 0.859188 0.687082
C 1.644394 0.803738 -0.691980
C -0.005206 2.495207 -0.058528
H -0.874759 0.209900 1.110532
H -2.105007 1.484932 1.484770
H 0.846979 0.135797 -1.071034
H 2.090144 1.370142 -1.529723
H 0.204171 3.079120 -0.971353
H -0.212670 3.140043 0.812734


