%chk=000088538.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088538

0 1
 O   -6.280100       1.069000      1.0000000E-03
 O    3.204100      -5.313600      -1.096700    
 O    3.155600       5.341400       1.098200    
 O   -6.269800      -1.126200      3.9999999E-04
 O    3.203800      -5.312500       1.098600    
 O    3.154200       5.342700      -1.097000    
 N  -4.6700001E-02 -3.9999999E-04 -1.3000000E-03
 N   -5.666800     -2.5699999E-02  7.9999998E-04
 N    2.886200      -4.794500      6.9999998E-04
 N    2.842000       4.820600      3.9999999E-04
 C   -1.457200     -6.6000000E-03 -8.9999998E-04
 C   0.7174000      -1.249000     -8.9999998E-04
 C   0.7058000       1.255300     -6.9999998E-04
 C   -2.160000       1.198200     -9.9999997E-05
 C    1.053300      -1.798900      -1.208600    
 C    1.037200       1.807000       1.207400    
 C   -2.149300      -1.217700     -1.1000000E-03
 C    1.053600      -1.798000       1.207300    
 C    1.036400       1.808600      -1.208400    
 C   -3.554900       1.191900      6.9999998E-04
 C    1.781100      -2.988900      -1.208200    
 C    1.754000       3.003600       1.208000    
 C   -3.544100      -1.223900     -3.0000001E-04
 C    1.781300      -2.988000       1.207700    
 C    1.753100       3.005200      -1.208000    
 C   -4.246900     -1.9099999E-02  6.0000003E-04
 C    2.145000      -3.583500       0.000000    
 C    2.111900       3.602800      3.0000001E-04
 H   -1.671100       2.167400      9.9999997E-05
 H   0.7691000      -1.341000      -2.150600    
 H   0.7577000       1.345600       2.149100    
 H   -1.651700      -2.182400     -1.9000000E-03
 H   0.7696000      -1.339400       2.149000    
 H   0.7562000       1.348300      -2.150400    
 H   -4.069700       2.149400      1.3000000E-03
 H    2.046300      -3.424600      -2.168100    
 H    2.015600       3.440700       2.168300    
 H   -4.050400      -2.186000     -6.0000003E-04
 H    2.046700      -3.422800       2.168000    
 H    2.013900       3.443500      -2.167900    


%chk=000088538-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088538

0 1
O -6.335733 0.965356 -0.566610
O 2.385103 -5.807337 -1.391203
O 2.324897 5.827271 1.398782
O -6.327482 -1.020879 0.562535
O 3.968678 -5.058113 0.075447
O 3.914034 5.098940 -0.072309
N -0.003204 -0.001012 -0.001318
N -5.726619 -0.025333 -0.002194
N 2.873678 -4.912870 -0.596020
N 2.821920 4.940288 0.600616
C -1.437730 -0.007383 -0.001879
C 0.719386 -1.230288 -0.151701
C 0.706845 1.235929 0.150719
C -2.159044 1.043493 -0.635481
C 0.240827 -2.239285 -1.034535
C 0.217669 2.238017 1.035348
C -2.150341 -1.064308 0.631553
C 1.920004 -1.451668 0.580524
C 1.904739 1.470837 -0.581438
C -3.563122 1.041843 -0.635530
C 0.942586 -3.446344 -1.181128
C 0.906597 3.452307 1.183835
C -3.554371 -1.074429 0.631375
C 2.628676 -2.655073 0.435529
C 2.600696 2.681543 -0.434684
C -4.248560 -0.019160 -0.002121
C 2.132045 -3.643254 -0.444008
C 2.093643 3.662736 0.446656
H -1.616076 1.848810 -1.138298
H -0.670444 -2.066970 -1.614298
H -0.691809 2.054926 1.614648
H -1.600683 -1.865056 1.134428
H 2.283343 -0.686666 1.272715
H 2.276044 0.710502 -1.274572
H -4.135866 1.833252 -1.125748
H 0.597989 -4.229130 -1.861675
H 0.554043 4.230337 1.865750
H -4.120569 -1.870588 1.121502
H 3.545428 -2.849636 0.998023
H 3.515183 2.886898 -0.997035


