%chk=000026239.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026239

0 1
 O  -0.4408000      -1.096300      0.9598000    
 O   -1.112000       2.888800      0.3242000    
 O  -0.3000000       1.485300       1.917300    
 N   -5.150000      0.6022000      -1.466000    
 C    3.773300     -0.9283000      3.4699999E-02
 C    2.251800     -0.9799000     -0.1208000    
 C    4.415500      0.2768000     -0.6582000    
 C    1.661900      -2.186600      0.6077000    
 C    5.926500      0.3690000     -0.4410000    
 C   0.1532000      -2.271000      0.4248000    
 C    6.503900       1.619300      -1.087400    
 C   -1.597500     -0.6625000      0.3659000    
 C   -1.918300      0.6906000      0.3444000    
 C   -2.445500      -1.599600     -0.2153000    
 C   -3.100300       1.111600     -0.2649000    
 C   -3.954800      0.1769000     -0.8496000    
 C   -3.627400      -1.178700     -0.8248000    
 C   -1.039700       1.682400      0.9491000    
 H    4.212600      -1.848800     -0.3690000    
 H    4.023400     -0.9002000       1.102700    
 H    1.996800      -1.028600      -1.186300    
 H    1.820800     -5.1800001E-02  0.2722000    
 H    4.204100      0.2288000      -1.733500    
 H    3.942900       1.193800     -0.2841000    
 H    1.892300      -2.101700       1.676800    
 H    2.123800      -3.110600      0.2415000    
 H    6.415800     -0.5175000     -0.8601000    
 H    6.147300      0.3856000      0.6325000    
 H  -4.4700000E-02  -2.388200     -0.6487000    
 H  -0.2320000      -3.145200      0.9619000    
 H    6.323400       1.621500      -2.167100    
 H    7.585100       1.665300     -0.9235000    
 H    6.057100       2.523500     -0.6619000    
 H   -2.247800      -2.666900     -0.1904000    
 H   -3.378500       2.163100     -0.2827000    
 H   -4.289000      -1.917100      -1.270700    
 H   -5.769400     -7.5400002E-02  -1.890200    
 H   -5.388300       1.584900      -1.485100    
 H  -0.5169000       3.550200      0.7374000    


%chk=000026239-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000026239

0 1
O -0.341788 -0.750838 0.309413
O -2.077223 3.102999 0.856168
O -0.074944 1.948668 0.743300
N -5.770169 0.338587 -0.884655
C 3.988625 -0.884278 0.141530
C 2.512032 -0.954438 -0.305462
C 4.806160 0.169983 -0.638307
C 1.702119 -2.012620 0.475364
C 6.280774 0.261235 -0.184205
C 0.232945 -2.086219 0.050731
C 7.090055 1.314494 -0.971654
C -1.675271 -0.518514 -0.023008
C -2.188272 0.808879 0.150084
C -2.549230 -1.529436 -0.499598
C -3.554191 1.069214 -0.135174
C -4.428131 0.058361 -0.605304
C -3.896845 -1.249358 -0.787750
C -1.320361 1.927624 0.596921
H 4.465818 -1.880611 0.020279
H 4.030469 -0.648071 1.225635
H 2.467185 -1.184333 -1.391482
H 2.028410 0.030689 -0.166644
H 4.771641 -0.066647 -1.722772
H 4.324156 1.162789 -0.522113
H 1.745872 -1.786559 1.558623
H 2.149292 -3.018866 0.335022
H 6.759510 -0.733679 -0.295396
H 6.313086 0.501813 0.898264
H 0.137292 -2.323874 -1.030230
H -0.316846 -2.850806 0.638879
H 7.096436 1.080852 -2.053346
H 8.140526 1.360472 -0.629225
H 6.649904 2.322427 -0.850543
H -2.181634 -2.548607 -0.645611
H -3.919484 2.089378 0.013070
H -4.545865 -2.053634 -1.155849
H -6.395586 -0.386378 -1.221285
H -6.143485 1.273093 -0.751487
H -1.434382 3.810910 1.129419


