%chk=000011501.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000011501

0 1
 O    5.488800     -0.4593000      4.4999998E-03
 N   5.5599999E-02  0.6695000     -6.2000002E-03
 C   -2.201700     -0.2129000      1.6000000E-03
 C    1.431500      0.3837000     -3.5000001E-03
 C    2.107800      0.2333000      -1.210100    
 C    2.107500      0.2536000       1.205900    
 C   -3.013000      -1.347500      9.3000000E-03
 C   -2.778700       1.057000     -6.8999999E-03
 C  -0.7543000     -0.3536000      2.0000001E-03
 C    4.156400     -0.1815000      1.7000000E-03
 C    3.473600     -5.0099999E-02  -1.207500    
 C    3.473300     -2.9600000E-02   1.208300    
 C   -4.401300      -1.212300      8.5000005E-03
 C   -4.167000       1.192200     -7.7000000E-03
 C   -4.978300      5.7500001E-02   0.000000    
 H    1.583600      0.3348000      -2.156700    
 H    1.583200      0.3710000       2.150500    
 H   -2.578200      -2.343700      1.5900001E-02
 H   -2.171900       1.958600     -1.3100000E-02
 H  -0.3530000      -1.384800      1.0200000E-02
 H    3.994100     -0.1662000      -2.154400    
 H    3.999700     -0.1310000       2.153500    
 H   -5.033100      -2.095700      1.4400000E-02
 H   -4.616800       2.180900     -1.4300000E-02
 H   -6.059300      0.1628000     -6.0000003E-04
 H    5.797500     -0.5314000     -0.9151000    


%chk=000011501-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000011501

0 1
O 5.662675 -0.278932 0.059210
N 0.044209 0.507720 -0.016419
C -2.274668 -0.251328 0.002064
C 1.452577 0.255816 -0.017680
C 2.164452 0.162002 -1.241353
C 2.171341 0.181765 1.206025
C -3.150231 -1.370133 0.017743
C -2.821552 1.061769 -0.009426
C -0.814342 -0.475969 -0.001978
C 4.267021 -0.100988 -0.016545
C 3.564433 -0.018497 -1.242575
C 3.568469 0.001058 1.207971
C -4.549381 -1.183348 0.021723
C -4.217528 1.246204 -0.005345
C -5.085894 0.125211 0.010175
H 1.619244 0.239425 -2.187671
H 1.629630 0.274808 2.153144
H -2.730812 -2.384437 0.027063
H -2.129791 1.910555 -0.021049
H -0.486167 -1.537739 0.009247
H 4.101761 -0.093674 -2.197498
H 4.128286 -0.062126 2.145895
H -5.218450 -2.050776 0.033987
H -4.634852 2.259324 -0.013996
H -6.171871 0.272267 0.013458
H 6.057441 -0.334679 -0.845969


