%chk=000059686.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059686

0 1
 O    2.211900      0.4160000      -1.016900    
 O   -2.733300       2.331300      0.6140000    
 N   -1.910100      0.3154000     -0.2150000    
 C   0.5305000       2.052100     -0.6318000    
 C  -0.3990000       2.051500      0.5336000    
 C   2.1299999E-02   3.347600     -7.1099997E-02
 C    1.948600       1.675900     -0.4106000    
 C   -1.802600       1.590900      0.3187000    
 C   -3.166000     -0.3209000     -0.4988000    
 C   -3.695900      -1.122800      0.6876000    
 C   -5.029400      -1.854800      0.4367000    
 C    3.190200     -0.3522000     -0.4428000    
 C   -4.878000      -2.811800     -0.7490000    
 C   -6.185800     -0.8889000      0.1751000    
 C    4.254500      0.2616000      0.2083000    
 C    3.109600      -1.738200     -0.5175000    
 C    5.250900     -0.5206000      0.7921000    
 C    4.106100      -2.520400      6.6299997E-02
 C    5.176700      -1.911500      0.7212000    
 H   0.1719000       1.786900      -1.619200    
 H  -3.8999999E-03   1.831000       1.519700    
 H   0.7041000       3.970900      0.4942000    
 H  -0.6919000       3.905200     -0.6667000    
 H    2.158300       1.664300      0.6670000    
 H    2.593100       2.425200     -0.8854000    
 H   -1.061800     -0.2109000     -0.4040000    
 H   -2.986500     -0.9672000      -1.362700    
 H   -3.883600      0.4506000     -0.7957000    
 H   -3.814800     -0.4555000       1.551300    
 H   -2.937600      -1.859800      0.9843000    
 H   -5.265200      -2.442000       1.332900    
 H   -5.762800      -3.453300     -0.8290000    
 H   -4.008700      -3.465100     -0.6202000    
 H   -4.777200      -2.282700      -1.701900    
 H   -7.131500      -1.436800      0.1009000    
 H   -6.281200     -0.1684000      0.9940000    
 H   -6.054100     -0.3309000     -0.7571000    
 H    4.367100       1.340300      0.2593000    
 H    2.277400      -2.216300      -1.026300    
 H    6.088500     -4.6999998E-02   1.295800    
 H    4.048500      -3.603600      1.0800000E-02
 H    5.953400      -2.520600       1.174300    


%chk=000059686-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000059686

0 1
O 2.451784 0.287490 -0.470784
O -2.170900 1.570173 -1.092558
N -2.192583 -0.255063 0.361723
C 0.723030 1.961331 -0.360268
C -0.384374 1.375674 0.546224
C -0.085270 2.888092 0.544159
C 2.165980 1.670173 -0.034192
C -1.648710 0.920991 -0.129577
C -3.434300 -0.840476 -0.171933
C -4.607792 -0.740525 0.832611
C -5.948545 -1.352387 0.333336
C 3.762043 -0.192139 -0.303252
C -5.856432 -2.884121 0.120312
C -6.477329 -0.644103 -0.938289
C 4.818007 0.542868 0.293266
C 3.988096 -1.509644 -0.776768
C 6.095789 -0.053904 0.411536
C 5.265651 -2.088611 -0.651030
C 6.329388 -1.365292 -0.055489
H 0.470731 1.986947 -1.424948
H -0.043937 0.795198 1.411402
H 0.394927 3.309718 1.432793
H -0.835577 3.518897 0.061048
H 2.356312 1.763154 1.056330
H 2.838094 2.370794 -0.571924
H -1.721269 -0.729916 1.133484
H -3.246228 -1.895498 -0.448459
H -3.661640 -0.278536 -1.093223
H -4.761699 0.330257 1.071236
H -4.319076 -1.243300 1.779789
H -6.687450 -1.176083 1.143724
H -6.850963 -3.306872 -0.114341
H -5.476385 -3.394335 1.025852
H -5.184696 -3.137252 -0.721235
H -7.491805 -1.002911 -1.193410
H -6.528151 0.451400 -0.796047
H -5.827506 -0.839809 -1.811436
H 4.663450 1.561230 0.662013
H 3.155489 -2.050839 -1.237008
H 6.910369 0.516689 0.872264
H 5.433474 -3.106638 -1.020240
H 7.321702 -1.818322 0.039708


