%chk=000015657.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015657

0 1
 O   0.4508000      -2.177500     -0.5692000    
 N  -0.6769000     -0.1580000     -0.4038000    
 C   -2.004500     -0.6886000     -0.6199000    
 C   -2.638900      -1.139900      0.6999000    
 C   -2.893100      0.3282000      -1.344400    
 C   -3.033500      3.7300002E-02   1.591800    
 C   -3.287100       1.503200     -0.4491000    
 C   -3.926200       1.029400      0.8526000    
 C   0.4527000     -0.9613000     -0.3971000    
 C    1.740000     -0.2677000     -0.1348000    
 C    2.776000     -0.9791000      0.4339000    
 C    1.858400       1.065500     -0.4688000    
 C    3.984800     -0.3279000      0.6800000    
 C    3.067200       1.716600     -0.2227000    
 C    4.130400       1.019800      0.3517000    
 H   -1.901800      -1.569800      -1.265700    
 H   -1.956900      -1.798800       1.250300    
 H   -3.538000      -1.729400      0.4786000    
 H   -3.806100     -0.1758000      -1.686200    
 H   -2.385400      0.7079000      -2.239200    
 H   -2.131900      0.5506000       1.947600    
 H   -3.556400     -0.3355000       2.479900    
 H   -3.990700       2.149600     -0.9864000    
 H   -2.407700       2.117800     -0.2244000    
 H   -4.891400      0.5565000      0.6331000    
 H   -4.133000       1.891100       1.497100    
 H  -0.6081000      0.8174000     -0.1354000    
 H    2.677400      -2.027200      0.7001000    
 H    1.068000       1.633500     -0.9483000    
 H    4.812500     -0.8700000       1.128000    
 H    3.183900       2.764000     -0.4854000    
 H    5.072100       1.526300      0.5417000    


%chk=000015657-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000015657

0 1
O 0.345369 -2.189992 -0.294853
N -0.699710 -0.121125 -0.442938
C -2.046502 -0.697512 -0.667183
C -2.686419 -1.190937 0.661027
C -2.954598 0.346917 -1.361546
C -3.063930 -0.021738 1.599448
C -3.344506 1.517129 -0.422295
C -3.986826 0.997660 0.887309
C 0.420281 -0.917596 -0.284449
C 1.736298 -0.202050 -0.089609
C 2.795493 -0.934256 0.504646
C 1.964764 1.140186 -0.492680
C 4.052083 -0.330237 0.717108
C 3.225008 1.743599 -0.284970
C 4.269694 1.012651 0.326880
H -1.898848 -1.573194 -1.325991
H -1.987865 -1.890444 1.153696
H -3.598633 -1.768295 0.405761
H -3.879715 -0.171215 -1.682482
H -2.461676 0.724383 -2.278435
H -2.141545 0.491587 1.941151
H -3.558769 -0.415000 2.507957
H -4.040194 2.197976 -0.949291
H -2.451457 2.130184 -0.171750
H -4.951532 0.505250 0.644450
H -4.219808 1.844800 1.560978
H -0.622246 0.888299 -0.314364
H 2.606699 -1.976606 0.781764
H 1.182500 1.712833 -1.006213
H 4.861492 -0.903408 1.182535
H 3.395111 2.776439 -0.608708
H 5.246589 1.481913 0.488549


