%chk=000091827.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091827

0 1
 O   -2.727500      -2.295600      -1.406300    
 O   -3.666300      -1.753600      0.5873000    
 O   -3.258400       1.665900      -1.394900    
 O    5.140800     -0.8388000     -0.1671000    
 N   -2.310100      0.6416000      0.4690000    
 N    3.512800      0.7865000      0.1959000    
 C  -0.5122000      -1.050200      0.5365000    
 C   0.6696000     -7.8199998E-02  0.6395000    
 C   -1.732700     -0.4957000     -0.2000000    
 C    1.893600     -0.6835000       1.334500    
 C    3.039000      0.3162000       1.468600    
 C   -2.821200      -1.548900     -0.2745000    
 C   -3.027000       1.629900     -0.1892000    
 C    4.529000      0.1664000     -0.5189000    
 C   -3.540000       2.688600      0.7499000    
 C    4.810800      0.8492000      -1.830400    
 H  -0.1748000      -1.962800      2.7899999E-02
 H  -0.8027000      -1.359300       1.549800    
 H   0.9410000      0.2456000     -0.3725000    
 H   0.3560000      0.8189000       1.186900    
 H   -1.466100     -0.1945000      -1.219900    
 H    2.232200      -1.561200      0.7705000    
 H    1.608800      -1.032400       2.334200    
 H    3.870500     -0.1507000       2.007900    
 H    2.717100       1.192200       2.041800    
 H   -2.245300      0.6800000       1.482500    
 H    3.067300       1.610300     -0.1980000    
 H   -3.853500       3.566400      0.1782000    
 H   -4.394700       2.295800       1.307300    
 H   -2.755900       2.990500       1.450200    
 H   -3.418000      -2.991400      -1.443000    
 H    5.752000      0.4772000      -2.244500    
 H    3.999300      0.6379000      -2.532000    
 H    4.895400       1.930100      -1.685800    


%chk=000091827-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091827

0 1
O -2.644257 -2.857472 -0.959773
O -4.087386 -1.758679 0.491589
O -1.397314 1.970192 -0.926495
O 5.292964 -0.324014 -0.064962
N -2.516690 0.495547 0.482678
N 3.295090 0.865759 0.071348
C -0.666229 -1.242345 0.617922
C 0.470443 -0.200564 0.656137
C -1.934647 -0.707489 -0.124640
C 1.776709 -0.769466 1.251928
C 2.897300 0.292030 1.367978
C -3.012632 -1.785684 -0.151616
C -2.240512 1.767163 0.002277
C 4.475123 0.507590 -0.566458
C -3.009521 2.902259 0.669908
C 4.728443 1.189573 -1.909786
H -0.326740 -2.153554 0.089556
H -0.943523 -1.541789 1.648782
H 0.650985 0.168540 -0.371602
H 0.144378 0.677206 1.248878
H -1.638884 -0.450410 -1.159807
H 2.143232 -1.610958 0.632458
H 1.582755 -1.175826 2.266040
H 3.806954 -0.164176 1.795541
H 2.568245 1.111407 2.037530
H -3.278023 0.347268 1.151158
H 2.663704 1.524149 -0.387359
H -2.294965 3.589555 1.155450
H -3.539466 3.479939 -0.106492
H -3.739212 2.558164 1.422660
H -3.349976 -3.559290 -0.932822
H 5.671046 1.760790 -1.850186
H 4.864373 0.416634 -2.685545
H 3.917033 1.870350 -2.220875


