%chk=000151616.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151616

0 1
 O  -0.2491000      -2.326700      0.1712000    
 O   -1.540900       2.846600     -0.1820000    
 N    2.293400      -1.822200      6.2899999E-02
 C   0.5326000     -9.5500000E-02 -1.7200001E-02
 C    1.881300     -0.4705000     -2.5900001E-02
 C   0.1841000       1.253800     -0.1077000    
 C    2.875200      0.5037000     -0.1250000    
 C   -1.932100     -0.7244000      9.4999999E-02
 C  -0.5129000      -1.133900      8.7800004E-02
 C   -2.280500      0.6248000      4.1000000E-03
 C   -1.235200       1.663200     -0.1008000    
 C    4.325700      0.1403000     -0.1374000    
 C    1.184600       2.228100     -0.2065000    
 C    2.527500       1.850100     -0.2149000    
 C   -2.932600      -1.698800      0.1940000    
 C   -3.629400      0.9998000      1.1800000E-02
 C    4.923200      0.1040000       1.265200    
 C   -4.275500      -1.320800      0.2012000    
 C   -4.623300      2.5599999E-02  0.1101000    
 C    2.483900      -2.647400      -1.085900    
 H    4.514200     -0.8116000     -0.6406000    
 H    4.879200      0.8776000     -0.7341000    
 H   0.9395000       3.284500     -0.2774000    
 H    3.291900       2.619200     -0.2898000    
 H    1.903000      -2.301900      0.8704000    
 H   -2.690500      -2.755600      0.2661000    
 H   -3.926500       2.042800     -5.7799999E-02
 H    4.822900       1.073300       1.765300    
 H    5.988500     -0.1425000       1.215400    
 H    4.429700     -0.6488000       1.888800    
 H   -5.051200      -2.077200      0.2778000    
 H   -5.669600      0.3170000      0.1159000    
 H    3.232300      -2.233200      -1.768000    
 H    1.554200      -2.776100      -1.649100    
 H    2.828800      -3.639300     -0.7780000    


%chk=000151616-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151616

0 1
O -0.417166 -2.414085 0.085118
O -1.606525 2.976708 -0.136266
N 2.079969 -1.916286 -0.287017
C 0.425514 -0.146710 -0.145561
C 1.823554 -0.559791 -0.284049
C 0.086346 1.249315 -0.197075
C 2.845532 0.467432 -0.392226
C -2.059015 -0.671475 0.139564
C -0.645918 -1.136469 0.025301
C -2.393330 0.710856 0.090706
C -1.325330 1.734296 -0.082507
C 4.343364 0.196129 -0.295106
C 1.088656 2.216191 -0.375418
C 2.439853 1.813926 -0.456804
C -3.088588 -1.632144 0.306021
C -3.745580 1.117874 0.206378
C 4.780751 -0.122638 1.162016
C -4.431360 -1.221655 0.419378
C -4.762450 0.157408 0.369458
C 3.262837 -2.648061 -0.747358
H 4.670702 -0.616461 -0.962989
H 4.881341 1.101901 -0.631069
H 0.797073 3.268938 -0.425336
H 3.219097 2.580426 -0.547643
H 1.209066 -2.474831 -0.122883
H -2.806567 -2.688433 0.342997
H -3.966054 2.189166 0.164479
H 4.552979 0.727392 1.829708
H 5.867655 -0.318325 1.209597
H 4.251253 -1.006451 1.560731
H -5.222206 -1.968832 0.546645
H -5.807441 0.473286 0.458138
H 4.134633 -2.540589 -0.076449
H 3.566442 -2.351709 -1.769665
H 2.997311 -3.718299 -0.775913


