%chk=000041179.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041179

0 1
 O   -1.142800       1.364000     -0.4404000    
 O    6.035200      -1.247100     -0.2493000    
 O    3.999300      -1.601900      -1.179600    
 N  -0.6673000     -0.6430000      0.4992000    
 C    4.266900      0.2809000      0.3533000    
 C    2.830600      0.6174000      0.1201000    
 C   0.5011000      3.7099998E-02  0.2545000    
 C   0.2140000       1.266100     -0.3209000    
 C    1.840800     -0.3066000      0.4855000    
 C    2.497100       1.848100     -0.4587000    
 C   -1.594900      0.1848000      7.0799999E-02
 C    1.165700       2.206500     -0.6960000    
 C   -3.022700      2.4100000E-02  6.2899999E-02
 C    4.620800      5.3500000E-02   1.836200    
 C   -3.612900      -1.239200     -5.3800002E-02
 C    4.724300     -0.9446000     -0.4442000    
 C   -3.837800       1.155600      0.1744000    
 C   -5.001700      -1.369000     -5.9400000E-02
 C   -2.781000      -2.475700     -0.1754000    
 C   -5.226500       1.025700      0.1689000    
 C   -5.808500     -0.2366000      5.1899999E-02
 H    4.887600       1.111500     -1.0200000E-02
 H    2.088600      -1.262400      0.9355000    
 H    3.277000       2.554200     -0.7364000    
 H   0.8971000       3.155500      -1.142800    
 H    4.271600      0.8906000       2.450700    
 H    4.165800     -0.8645000       2.224700    
 H    5.703600     -3.2800000E-02   1.977400    
 H   -3.415600       2.152800      0.2762000    
 H   -5.472600      -2.344500     -0.1480000    
 H   -2.055900      -2.387700     -0.9912000    
 H   -2.265400      -2.690500      0.7661000    
 H   -3.398700      -3.350900     -0.4079000    
 H   -5.855100       1.907000      0.2579000    
 H   -6.889900     -0.3375000      4.8599999E-02
 H    6.308000      -2.036400     -0.7639000    


%chk=000041179-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000041179

0 1
O -1.108032 1.510448 -0.226568
O 5.430477 -0.449430 -1.615452
O 4.579781 -2.148492 -0.282516
N -0.624503 -0.714695 0.238633
C 4.409011 0.212163 0.476494
C 2.934602 0.589093 0.252421
C 0.583947 0.024187 0.189753
C 0.287611 1.387175 -0.096043
C 1.917621 -0.390377 0.369318
C 2.604203 1.945496 -0.040669
C -1.599453 0.159550 -0.004370
C 1.267931 2.376355 -0.219246
C -3.048613 -0.012462 -0.085908
C 4.685928 -0.194552 1.946495
C -3.670650 -1.294674 0.089228
C 4.793379 -0.929570 -0.462406
C -3.850018 1.137497 -0.349940
C -5.083297 -1.359933 -0.011149
C -2.892179 -2.563435 0.371453
C -5.249136 1.039712 -0.442738
C -5.871746 -0.218579 -0.272330
H 5.034598 1.079478 0.205048
H 2.155510 -1.437904 0.577936
H 3.413187 2.678825 -0.133883
H 1.023122 3.417505 -0.443442
H 4.376675 0.618221 2.625832
H 4.124286 -1.106411 2.210148
H 5.760313 -0.397007 2.105773
H -3.355642 2.104012 -0.480259
H -5.570086 -2.333259 0.119973
H -2.153492 -2.771659 -0.422615
H -2.299361 -2.477854 1.299203
H -3.577143 -3.423965 0.460304
H -5.848821 1.933182 -0.645617
H -6.961326 -0.310625 -0.342179
H 5.627120 -1.213516 -2.223982


