%chk=000035316.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000035316

0 1
 O   -3.703200      0.2534000      0.1311000    
 O   9.0200000E-02   2.878000     -0.2195000    
 N   0.5018000      -1.750200      0.1117000    
 N   0.3354000      0.5830000     -5.5700000E-02
 N   -1.632200     -0.7783000      0.1260000    
 N   -1.834900       1.606600     -4.4100001E-02
 C    1.898200      -1.944900      7.0200004E-02
 C  -0.3021000     -0.5950000      5.8300000E-02
 C    2.754300     -0.9629000      0.5686000    
 C    2.423000      -3.119600     -0.4689000    
 C    4.135200      -1.155700      0.5280000    
 C    3.803900      -3.312300     -0.5094000    
 C    4.659900      -2.330400     -1.0900000E-02
 C   -2.333900      0.3652000      6.9200002E-02
 C  -0.4936000       1.638400     -0.1008000    
 C   -4.228500      -1.061100      0.2488000    
 C    1.508900       2.908400     -0.2816000    
 C   -5.714600     -0.9757000      0.3588000    
 C    1.950900       4.322300     -0.4655000    
 C   -6.561600      -1.544100     -0.5064000    
 C    2.743000       4.974900      0.3923000    
 H  -4.1900001E-02  -2.606500      6.0500000E-02
 H    2.389300     -5.5500001E-02   1.037400    
 H    1.766600      -3.892200     -0.8612000    
 H    4.801900     -0.3959000      0.9254000    
 H    4.212600      -4.227100     -0.9286000    
 H    5.735100      -2.481400     -4.0300000E-02
 H   -3.937900      -1.660700     -0.6232000    
 H   -3.847200      -1.541900       1.158300    
 H    1.933200       2.488000      0.6387000    
 H    1.864300       2.325500      -1.140500    
 H   -6.122800     -0.4196000       1.198600    
 H    1.606400       4.842200      -1.355500    
 H   -7.633200      -1.447200     -0.3697000    
 H   -6.206800      -2.111400      -1.359700    
 H    3.030800       6.002700      0.2004000    
 H    3.116000       4.501800       1.293900    


%chk=000035316-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000035316

0 1
O -3.670647 0.246790 0.055994
O 0.031580 2.972454 -0.017954
N 0.549342 -1.745370 -0.010598
N 0.403716 0.646676 -0.019245
N -1.557176 -0.793146 0.022925
N -1.830299 1.626432 0.017849
C 1.951433 -1.973078 -0.028321
C -0.192612 -0.584537 -0.003838
C 2.923116 -0.937048 -0.041840
C 2.375041 -3.331540 -0.031673
C 4.294083 -1.273304 -0.058789
C 3.747095 -3.649719 -0.048424
C 4.718878 -2.621529 -0.062401
C -2.302600 0.345805 0.032372
C -0.473866 1.697400 -0.007860
C -4.250913 -1.133687 0.103943
C 1.521206 3.119354 -0.080941
C -5.736712 -0.966998 0.259824
C 1.798592 4.590546 -0.216793
C -6.650613 -1.597835 -0.517159
C 2.674622 5.266879 0.565446
H -0.046585 -2.578099 0.002168
H 2.589823 0.101399 -0.038178
H 1.628514 -4.136388 -0.020522
H 5.037519 -0.468066 -0.069508
H 4.056582 -4.700645 -0.050548
H 5.785573 -2.868490 -0.076078
H -3.980316 -1.676366 -0.819032
H -3.797408 -1.661819 0.964715
H 1.970135 2.688153 0.831648
H 1.881814 2.546092 -0.957081
H -6.057780 -0.311226 1.080019
H 1.261168 5.102268 -1.026161
H -7.725572 -1.484675 -0.340910
H -6.351879 -2.245027 -1.351289
H 2.881095 6.330169 0.403715
H 3.210550 4.778976 1.389225


