%chk=000015248.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015248

0 1
 O   -1.819700      0.3646000      0.6890000    
 O   -3.573900      0.4678000      -1.594800    
 O   -1.606600       3.139600      0.9301000    
 O    7.093000      -1.162800      0.1816000    
 N    1.438400       1.304400     -0.1132000    
 C   -1.566900       1.198800     -0.4501000    
 C  -0.7764000       2.408000      2.7799999E-02
 C   0.5201000       2.033000      0.7512000    
 C   -2.887000       1.615100      -1.084900    
 C    2.679200      0.9978000      0.5858000    
 C    3.626900      0.2247000     -0.3294000    
 C   -2.748500     -0.6063000      0.4216000    
 C    4.932400     -0.1152000      0.3878000    
 C   -3.591100     -0.5619000     -0.6912000    
 C    5.902300     -0.8495000     -0.5287000    
 C   -2.838500      -1.666100       1.324500    
 C   -4.493700      -1.599300     -0.9261000    
 C   -3.751100      -2.696300       1.096400    
 C   -4.573500      -2.665700     -3.0099999E-02
 C    8.034500      -1.830600     -0.6474000    
 H  -0.9742000      0.6173000      -1.169300    
 H  -0.5538000       3.070500     -0.8169000    
 H   0.2920000       1.448000       1.651300    
 H   0.9900000       2.958500       1.109700    
 H   -2.715000       2.293700      -1.927000    
 H   -3.555900       2.118000     -0.3752000    
 H    3.167400       1.922700      0.9164000    
 H    2.467700      0.3925000       1.475700    
 H    1.638100       1.855800     -0.9472000    
 H    3.846900      0.8210000      -1.224000    
 H    3.144700     -0.7008000     -0.6689000    
 H    5.411400      0.7985000      0.7613000    
 H    4.730600     -0.7317000       1.272600    
 H   -1.820700       2.556000       1.678200    
 H    6.147800     -0.2192000      -1.391600    
 H    5.443000      -1.776500     -0.8919000    
 H   -2.195400      -1.701900       2.199500    
 H   -5.144200      -1.579100      -1.796300    
 H   -3.818300      -3.525600       1.794600    
 H   -5.280200      -3.471300     -0.2075000    
 H    7.620700      -2.774700      -1.014900    
 H    8.924500      -2.048600     -5.0999999E-02
 H    8.325600      -1.193500      -1.488100    


%chk=000015248-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000015248

0 1
O -1.991566 0.482925 0.824724
O -3.163573 0.099756 -1.820225
O -1.792725 3.198795 0.965012
O 7.001652 -1.371343 0.033195
N 1.535115 1.682847 0.025550
C -1.439255 1.160473 -0.387499
C -0.819449 2.466229 0.146231
C 0.484661 2.192260 0.933243
C -2.570061 1.388282 -1.393921
C 2.687474 1.030956 0.691823
C 3.685812 0.478372 -0.343940
C -2.871435 -0.590248 0.543786
C 4.909853 -0.189918 0.321306
C -3.432624 -0.778664 -0.749026
C 5.881647 -0.778898 -0.705517
C -3.181870 -1.483307 1.588555
C -4.280276 -1.879105 -0.991475
C -4.042486 -2.575978 1.346136
C -4.583765 -2.778613 0.052958
C 7.986984 -1.984221 -0.853031
H -0.643054 0.524202 -0.818407
H -0.602861 3.139176 -0.705283
H 0.283745 1.417567 1.697805
H 0.759346 3.128200 1.471922
H -2.188923 1.846259 -2.320863
H -3.354919 2.031558 -0.952317
H 3.226424 1.717675 1.391695
H 2.294767 0.196138 1.304701
H 1.854891 2.414367 -0.626677
H 4.027762 1.305850 -1.002339
H 3.154605 -0.244838 -0.993045
H 5.457505 0.544024 0.943450
H 4.579356 -1.001231 0.998386
H -2.183012 2.538634 1.598440
H 6.255607 0.014508 -1.393917
H 5.376386 -1.557307 -1.323045
H -2.736997 -1.313105 2.574302
H -4.695648 -2.004687 -1.996298
H -4.282309 -3.267691 2.160148
H -5.244694 -3.629691 -0.140938
H 7.540546 -2.804969 -1.455534
H 8.775819 -2.396534 -0.204181
H 8.434143 -1.239004 -1.546491


