%chk=000148331.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148331

0 1
 O   -1.926800      -2.053400      -1.628200    
 O    2.922600      0.2100000     -0.2854000    
 O    6.254000       1.194600      0.1167000    
 O    4.645600       1.975700      -1.157000    
 N   -2.549300     -0.5597000      4.6900000E-02
 N    5.056000       1.147200     -0.2913000    
 C   -3.979800     -0.5984000     -0.1604000    
 C   -4.733200     -0.4015000       1.159300    
 C   -4.413000      0.4340000      -1.206800    
 C   -4.641700       1.034200       1.676300    
 C   -4.322000       1.868400     -0.6859000    
 C   -5.088500       2.042000      0.6217000    
 C   -1.654600      -1.292400     -0.7079000    
 C  -0.2682000      -1.115200     -0.3410000    
 C   0.8845000     -0.9685000     -3.6600001E-02
 C    2.258300     -0.7932000      0.3272000    
 C    3.053200      -1.467900       1.204400    
 C    4.185800      0.1792000      0.2140000    
 C    4.317100     -0.8349000       1.134000    
 H   -4.222500      -1.596100     -0.5473000    
 H   -4.348800      -1.087900       1.923400    
 H   -5.790300     -0.6545000       1.007300    
 H   -5.451800      0.2311000      -1.497200    
 H   -3.806800      0.3393000      -2.115700    
 H   -3.614600       1.258600       1.986900    
 H   -5.268200       1.139600       2.569600    
 H   -4.720700       2.557400      -1.439100    
 H   -3.270600       2.140400     -0.5329000    
 H   -6.162200       1.919500      0.4331000    
 H   -4.945800       3.060300       1.000700    
 H   -2.183900      7.1099997E-02  0.7547000    
 H    2.775100      -2.309300       1.823100    
 H    5.209000      -1.091300       1.688200    


%chk=000148331-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000148331

0 1
O -2.139468 -2.405503 -0.920814
O 2.822393 0.282186 0.786169
O 6.289128 1.060190 1.238589
O 4.400247 2.122235 2.014390
N -2.568659 -0.501911 0.374699
N 5.001886 1.188150 1.356917
C -4.045657 -0.637958 0.328230
C -4.673629 0.116623 1.524949
C -4.618527 -0.120204 -1.021527
C -4.560735 1.656419 1.385721
C -4.493865 1.414826 -1.158067
C -5.149736 2.144142 0.039642
C -1.731001 -1.399416 -0.255753
C -0.305872 -1.117763 -0.097621
C 0.923958 -0.978972 -0.034356
C 2.316864 -0.820809 0.038577
C 3.393270 -1.549816 -0.491227
C 4.210180 0.190405 0.688136
C 4.600511 -0.905135 -0.077324
H -4.259669 -1.720624 0.405813
H -4.216607 -0.229560 2.472128
H -5.745535 -0.158349 1.566005
H -5.687805 -0.410866 -1.066193
H -4.108454 -0.638635 -1.853300
H -3.499227 1.977941 1.457439
H -5.081028 2.141476 2.233207
H -4.958472 1.743686 -2.106876
H -3.422105 1.694408 -1.219016
H -6.242013 1.948202 0.031046
H -5.019831 3.238860 -0.058480
H -2.156832 0.287344 0.878278
H 3.298962 -2.442895 -1.104731
H 5.625230 -1.190279 -0.299850


