%chk=000148371.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000148371

0 1
 O   -3.326300      0.8926000      0.4284000    
 O    3.338500      0.8572000     -0.4108000    
 N   -1.448600      6.5099999E-02  3.9799999E-02
 N    1.461600      2.2500001E-02 -3.4800000E-02
 N   -2.717500      0.1065000     -0.3041000    
 N    2.722800      8.6800002E-02  0.3325000    
 C  -0.7716000      -1.225200     -0.2108000    
 C  -0.6634000       1.238600     -0.3754000    
 C   0.7462000      -1.249500      0.2198000    
 C   0.7016000       1.224900      0.3457000    
 C   -1.520700      -2.359200      0.5309000    
 C  -0.4923000       1.363700      -1.902800    
 C    1.441500      -2.413600     -0.5291000    
 C   0.5283000       1.389700       1.870700    
 H  -0.8239000      -1.440800      -1.288100    
 H   -1.178700       2.153300     -4.5800000E-02
 H   0.7940000      -1.463800       1.297300    
 H    1.236000       2.122200     -2.0000001E-03
 H   -1.543600      -2.174100       1.611100    
 H   -2.554400      -2.459800      0.1825000    
 H   -1.050200      -3.332700      0.3704000    
 H   8.8200003E-02   2.260400      -2.146600    
 H   2.6600000E-02  0.5057000      -2.341600    
 H   -1.462200       1.460600      -2.402400    
 H    2.481900      -2.531000     -0.2064000    
 H   0.9518000      -3.372700     -0.3422000    
 H    1.442700      -2.240300      -1.611300    
 H   5.0000002E-04  0.5471000       2.328500    
 H    1.497300       1.489800       2.371400    
 H  -4.4000000E-02   2.297700       2.091500    


%chk=000148371-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000148371

0 1
O -3.123202 1.116482 0.867305
O 3.143938 1.031988 -0.888828
N -1.384613 0.002018 -0.044452
N 1.380286 -0.030385 0.034651
N -2.616409 -0.036919 0.598639
N 2.611108 -0.106397 -0.606994
C -0.719886 -1.291728 -0.351966
C -0.679842 1.272885 -0.369601
C 0.684932 -1.304442 0.356770
C 0.705900 1.260987 0.342701
C -1.588944 -2.499365 0.032971
C -0.571207 1.494725 -1.892777
C 1.525262 -2.536467 -0.014579
C 0.601869 1.505817 1.862663
H -0.530179 -1.314317 -1.445384
H -1.307195 2.067745 0.076978
H 0.495053 -1.310462 1.450353
H 1.352046 2.034694 -0.114161
H -1.726828 -2.571705 1.125251
H -2.589569 -2.422267 -0.420610
H -1.112107 -3.424141 -0.331565
H -0.168325 2.503195 -2.092371
H 0.104688 0.764771 -2.373409
H -1.565044 1.421784 -2.366878
H 2.527330 -2.477772 0.438571
H 1.026732 -3.445762 0.359739
H 1.661720 -2.623857 -1.105933
H -0.091828 0.798884 2.352230
H 1.593311 1.415461 2.338731
H 0.223101 2.526252 2.048254


