%chk=000129213.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129213

0 1
 O    2.141400      -4.236100     -0.5143000    
 O    1.525100      0.5430000       3.893000    
 O    3.271600      -2.482600      0.3858000    
 O    2.688200      0.8439000       1.964500    
 O   -4.471500       2.453100       1.778000    
 O   -4.126600      -2.647200      -1.732700    
 O   -3.544000       2.411500     -0.2957000    
 O   -2.957000     -0.8252000      -2.421600    
 N    1.075900     -0.9810000      0.6914000    
 N   -2.524600     -9.4499998E-02  0.1932000    
 C  -4.3499999E-02 -0.1052000      0.3233000    
 C   -1.346700     -0.9087000      0.4789000    
 C   0.1444000      0.4186000      -1.116700    
 C   0.8810000      -2.314100      0.1276000    
 C    1.207500      -1.049600       2.144200    
 C    1.426300       1.192000      -1.321800    
 C   -2.833700      0.7771000       1.327300    
 C   -3.672500     -0.9451000     -0.1229000    
 C    2.587600      0.5261000      -1.714200    
 C    1.448700       2.571900      -1.118200    
 C    2.217100      -2.997800      3.6200002E-02
 C    1.878700      0.2069000       2.626300    
 C   -3.643300       1.943100      0.8313000    
 C   -3.525700      -1.446700      -1.532900    
 C    3.770900       1.240300      -1.903100    
 C    2.631900       3.285800      -1.307200    
 C    3.792900       2.620200      -1.699600    
 H  -4.9199998E-02  0.7763000      0.9749000    
 H   -1.362300      -1.734900     -0.2382000    
 H   -1.453700      -1.361500       1.472400    
 H  -0.6925000       1.080200      -1.378000    
 H   9.3699999E-02 -0.3908000      -1.855800    
 H   0.2229000      -2.951600      0.7310000    
 H   0.5340000      -2.286900     -0.9114000    
 H   0.2541000      -1.180300       2.665700    
 H    1.861600      -1.869400       2.463900    
 H   -1.943800       1.214800       1.790300    
 H   -3.383400      0.2378000       2.108500    
 H   -4.617000     -0.3884000     -0.1018000    
 H   -3.757900      -1.786300      0.5755000    
 H    2.584100     -0.5462000      -1.887700    
 H   0.5512000       3.101300     -0.8093000    
 H    4.674500      0.7222000      -2.210800    
 H    2.649400       4.359900      -1.147900    
 H    4.714200       3.176000      -1.846900    
 H    3.023300      -4.660200     -0.5835000    
 H    1.984800       1.354200       4.197900    
 H   -4.978600       3.223600       1.443800    
 H   -4.036700      -2.951200      -2.661100    


%chk=000129213-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129213

0 1
O 2.621689 -4.569497 -0.059853
O 2.816010 0.409799 2.994325
O 3.659680 -2.537866 0.388248
O 0.587529 1.039913 2.923328
O -3.376828 2.898849 2.198116
O -4.987672 -1.513313 -2.184506
O -3.733424 2.516447 -0.064862
O -2.716213 -1.167190 -2.516469
N 1.041551 -1.338594 0.816739
N -2.515949 -0.104464 0.197073
C -0.028049 -0.493877 0.211940
C -1.450751 -1.123088 0.361138
C 0.286597 -0.117435 -1.263540
C 1.164708 -2.701643 0.303471
C 1.222958 -1.265239 2.284884
C 1.339716 0.975605 -1.391012
C -2.682154 0.764725 1.371193
C -3.793010 -0.596399 -0.333271
C 2.696347 0.751383 -1.030408
C 0.967856 2.262197 -1.862208
C 2.612628 -3.195473 0.234569
C 1.471002 0.165118 2.752475
C -3.308599 2.114652 1.038134
C -3.712500 -1.098492 -1.768972
C 3.649861 1.789157 -1.140143
C 1.921192 3.300607 -1.973232
C 3.268451 3.066978 -1.613020
H -0.026601 0.453043 0.775926
H -1.590530 -1.890060 -0.420222
H -1.525257 -1.637107 1.353586
H -0.663655 0.214819 -1.716193
H 0.596479 -1.021188 -1.825843
H 0.586960 -3.466493 0.875577
H 0.775331 -2.745280 -0.730383
H 0.341070 -1.647670 2.855372
H 2.105002 -1.868932 2.553643
H -1.701592 0.967796 1.839711
H -3.305212 0.307377 2.181642
H -4.520248 0.235155 -0.345570
H -4.254352 -1.414575 0.275911
H 2.999254 -0.228003 -0.644375
H -0.076239 2.447871 -2.143698
H 4.692178 1.596708 -0.859548
H 1.614275 4.286279 -2.342448
H 4.011115 3.868514 -1.702455
H 3.562772 -4.882033 -0.147787
H 2.945677 1.367146 3.239908
H -3.775858 3.783071 1.974688
H -4.940392 -1.821001 -3.129978


