%chk=000060737.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060737

0 1
 O   -2.292700     -0.5248000      0.7074000    
 O   -2.388500       2.926600     -0.2611000    
 O   -4.549900       1.435100      0.4757000    
 O   -2.762500      -2.712700     -0.9838000    
 O   0.4013000       2.946800      0.6821000    
 O    3.910600      -1.068300      0.1228000    
 N  -0.2852000      0.6658000      0.5774000    
 N    1.916500       1.120700      0.4345000    
 N  -2.0000000E-02  -1.814100      0.3800000    
 N    2.204100      -2.617300      0.1452000    
 N   0.3572000      -4.078600      0.1845000    
 C   -1.709900      0.7886000      0.6997000    
 C   -2.331000       1.530600     -0.4711000    
 C   -3.707000      0.9034000     -0.5462000    
 C   -3.413800     -0.5508000     -0.2031000    
 C   0.4057000     -0.5207000      0.4388000    
 C   -3.022600      -1.387900      -1.413500    
 C   0.6425000       1.753000      0.5799000    
 C    1.714300     -0.2356000      0.3550000    
 C    3.190900       1.789700      0.3805000    
 C    2.713100      -1.321700      0.1989000    
 C   0.9098000      -2.824800      0.2330000    
 C    3.511300       2.115100      -1.040500    
 C    4.605900       1.681900      -1.676100    
 H   -1.919300       1.284900       1.654700    
 H   -1.784400       1.339100      -1.402800    
 H   -4.210200       1.053700      -1.504900    
 H   -4.242800      -1.029500      0.3303000    
 H   -2.112500      -1.010500      -1.890000    
 H   -3.832100      -1.410300      -2.149700    
 H   -1.476200       3.253500     -0.1918000    
 H   -4.166600       1.224900       1.343500    
 H   -1.010600      -2.003800      0.4614000    
 H    3.098900       2.734200      0.9299000    
 H    3.963300       1.203800      0.8860000    
 H   -2.510900      -3.225500      -1.770700    
 H    2.816700       2.752100      -1.582900    
 H   0.9367000      -4.904100      7.8100003E-02
 H  -0.6453000      -4.217400      0.2499000    
 H    4.785700       1.957600      -2.709400    
 H    5.338100       1.052600      -1.182600    


%chk=000060737-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060737

0 1
O -2.379695 -0.565305 0.755110
O -2.448770 2.977624 -0.028057
O -4.639947 1.513446 0.419283
O -2.557785 -2.653022 -0.955316
O 0.262875 2.839781 0.630763
O 4.095528 -1.150711 0.247267
N -0.266666 0.505564 0.582264
N 1.906088 1.066954 0.505818
N 0.013550 -1.975201 0.376629
N 2.319404 -2.708780 0.226277
N 0.557576 -4.259925 0.161243
C -1.709177 0.727180 0.769192
C -2.316457 1.582216 -0.383084
C -3.724625 0.955998 -0.563864
C -3.494114 -0.535324 -0.243009
C 0.465106 -0.673629 0.472066
C -3.087364 -1.370352 -1.465644
C 0.629349 1.614199 0.583359
C 1.818056 -0.349198 0.418542
C 3.148195 1.871467 0.386475
C 2.845808 -1.385055 0.289197
C 1.012121 -2.954983 0.260190
C 3.450173 2.250329 -1.055622
C 4.420295 1.648742 -1.787237
H -1.877915 1.226559 1.742790
H -1.706284 1.448404 -1.299629
H -4.110339 1.111685 -1.592455
H -4.370321 -0.972608 0.261265
H -2.309180 -0.850301 -2.062744
H -3.978596 -1.541515 -2.102048
H -1.528589 3.283651 0.252861
H -4.339231 2.452129 0.578819
H -0.994891 -2.172621 0.245641
H 3.003973 2.774970 1.005355
H 3.965712 1.259533 0.798530
H -2.397332 -3.265436 -1.715953
H 2.830670 3.048280 -1.489090
H 1.275602 -4.978325 0.099523
H -0.394175 -4.516643 0.413716
H 4.621280 1.943270 -2.824065
H 5.018692 0.832253 -1.365359


