%chk=000089235.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089235

0 1
 O   -1.470500      0.6434000       1.473900    
 O  -0.1520000       3.194100     -0.5784000    
 O    1.823000       3.376100      0.5062000    
 N  -0.2247000      0.5844000     -0.4850000    
 N    1.775600      -1.783100     -0.3941000    
 N    3.673400      -2.577000      0.4427000    
 N   -6.021500      -1.449800      0.2313000    
 C   0.9898000       1.150200      5.5399999E-02
 C    2.227900      0.6470000     -0.6994000    
 C   -2.477900     -0.2559000     -0.5370000    
 C    2.629400     -0.7498000     -0.2855000    
 C   -3.759000     -0.5067000      0.2584000    
 C   -1.363600      0.3773000      0.2798000    
 C   0.9434000       2.671000      2.2900000E-02
 C   -4.829000      -1.214100     -0.5751000    
 C    3.783200      -1.226700      0.2226000    
 C    2.452500      -2.880300      6.1299998E-02
 H    1.044100      0.8756000       1.117000    
 H    3.082100       1.310600     -0.5118000    
 H    2.057800      0.6648000      -1.783900    
 H  -0.2618000      0.3919000      -1.482100    
 H   -2.695100      0.4024000      -1.386900    
 H   -2.100900      -1.204900     -0.9380000    
 H   -4.145800      0.4507000      0.6309000    
 H   -3.522700      -1.112400       1.143200    
 H   -4.448300      -2.174300     -0.9392000    
 H   -5.092100     -0.6056000      -1.447100    
 H   0.8250000      -1.765900     -0.7405000    
 H    4.695600     -0.6950000      0.4494000    
 H    2.002200      -3.862400      8.8299997E-02
 H   -6.743500      -1.873800     -0.3497000    
 H   -6.399900     -0.5596000      0.5528000    
 H  -0.1401000       4.174900     -0.5731000    


%chk=000089235-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000089235

0 1
O -1.107854 0.862538 1.602724
O 0.538273 3.349262 -1.707567
O 2.380593 3.557551 -0.305208
N -0.344692 1.114262 -0.586922
N 0.942571 -1.714409 -0.089352
N 2.528174 -2.841211 1.060110
N -4.847649 -2.653481 -0.204416
C 1.011812 1.504556 -0.184669
C 2.113739 0.496905 -0.672820
C -2.732806 0.581921 -0.212063
C 2.053019 -0.855569 -0.025428
C -3.103003 -0.909589 0.000798
C -1.348254 0.883095 0.359383
C 1.393575 2.898630 -0.686651
C -4.561597 -1.220034 -0.395917
C 3.018761 -1.579875 0.683642
C 1.269062 -2.887162 0.582979
H 1.018890 1.526569 0.921187
H 3.099230 0.939554 -0.445563
H 2.040701 0.417466 -1.777286
H -0.617240 1.309678 -1.553100
H -3.459864 1.213134 0.332671
H -2.800045 0.841754 -1.286570
H -2.943316 -1.160547 1.067528
H -2.441959 -1.569402 -0.595972
H -4.707038 -0.983579 -1.467968
H -5.236110 -0.536824 0.178263
H 0.037755 -1.470524 -0.491260
H 4.028781 -1.269761 0.944105
H 0.578631 -3.718831 0.700382
H -5.700168 -2.987198 -0.662569
H -4.787969 -2.964398 0.770335
H 0.842596 4.242621 -2.023505


