%chk=000077859.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077859

0 1
 O   -1.399700      8.0000004E-03  0.7693000    
 O   -1.720000     -8.8999998E-03  -1.541100    
 O    4.687400       1.093000     -0.3076000    
 O    4.684700      -1.102200     -0.2909000    
 N    4.087200     -3.0000000E-03 -0.1941000    
 C   -3.653100      4.8000002E-03 -4.1000001E-02
 C   -3.981600       1.263200      0.7732000    
 C   -4.488800     -3.6100000E-02  -1.327100    
 C   -3.978500      -1.236600      0.8051000    
 C   -2.162000      1.0000000E-03 -0.3982000    
 C  -2.4000000E-02  5.1000002E-03  0.5278000    
 C   0.6286000       1.211900      0.4053000    
 C   0.6272000      -1.204000      0.4218000    
 C    2.688700      5.0000002E-04  5.2200001E-02
 C    2.002500       1.209600      0.1643000    
 C    2.001200      -1.206300      0.1809000    
 H   -3.441300       1.286600       1.726300    
 H   -3.704100       2.168600      0.2211000    
 H   -5.052400       1.320900      0.9978000    
 H   -4.284000      0.8355000      -1.959700    
 H   -5.561500     -4.0899999E-02  -1.104100    
 H   -4.265600     -0.9309000      -1.919700    
 H   -3.444100      -1.229400       1.761800    
 H   -5.050100      -1.296400       1.025900    
 H   -3.689800      -2.154900      0.2807000    
 H   9.3999997E-02   2.152500      0.4935000    
 H   9.1499999E-02  -2.142800      0.5227000    
 H    2.505200       2.168800      6.9600001E-02
 H    2.502600      -2.167300      9.9399999E-02


%chk=000077859-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077859

0 1
O -1.402298 0.004511 0.606910
O -1.855384 -0.030993 -1.690689
O 4.844269 1.143734 -0.099908
O 4.846131 -1.137411 -0.080743
N 4.242805 0.003158 -0.031677
C -3.747410 -0.005731 -0.054203
C -3.997820 1.281293 0.786376
C -4.667647 -0.024090 -1.298196
C -4.000822 -1.264935 0.826575
C -2.287727 -0.014998 -0.527135
C 0.002508 0.003347 0.386879
C 0.685896 1.236447 0.307096
C 0.687796 -1.229875 0.327673
C 2.766186 0.003192 0.113037
C 2.086389 1.240469 0.168887
C 2.088270 -1.234024 0.189425
H -3.343367 1.312731 1.673412
H -3.822608 2.192436 0.185515
H -5.049987 1.293382 1.124174
H -4.491257 0.856670 -1.939475
H -5.723466 -0.017520 -0.973457
H -4.493820 -0.925047 -1.911499
H -3.348480 -1.268731 1.715754
H -5.053729 -1.265473 1.162337
H -3.825138 -2.195195 0.255898
H 0.120789 2.171621 0.356640
H 0.124242 -2.165028 0.392756
H 2.656281 2.170606 0.103443
H 2.659598 -2.164244 0.139397


