%chk=000117193.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117193

0 1
 O   -1.298800      3.5000001E-03 -0.2576000    
 O    3.588600     -5.3300001E-02 -0.3678000    
 O   -2.500700       1.291200       1.216400    
 O    4.894400       1.205800       1.049800    
 N   -3.549300     -3.7400000E-02 -0.3702000    
 N    5.835100     -0.1327000     -0.5660000    
 C    1.141900     -0.1569000     -0.3752000    
 C    1.125900      -1.710700     -0.2924000    
 C  -8.7399997E-02  0.4691000      0.3227000    
 C    2.415600      0.4401000      0.2663000    
 C    1.112600      0.2191000      -1.875000    
 C    1.150800      -2.291600       1.116200    
 C   -2.458500      0.4947000      0.2845000    
 C   -4.918500      0.2808000     -3.6699999E-02
 C    4.779100      0.4115000      0.1224000    
 C   -5.433400     -0.6623000       1.042900    
 C   -5.797600      0.2290000      -1.280200    
 H   0.2340000      -2.096300     -0.8030000    
 H    1.984700      -2.116600     -0.8425000    
 H  -8.2500003E-02  0.2370000       1.394300    
 H  -5.0000001E-02   1.561600      0.2195000    
 H    2.453800      0.2077000       1.337200    
 H    2.399000       1.533300      0.1644000    
 H    1.977900     -0.1883000      -2.409700    
 H    1.122300       1.306900      -2.007900    
 H   0.2148000     -0.1676000      -2.369900    
 H    2.055500      -2.003100       1.658100    
 H    1.137100      -3.385600       1.063400    
 H   0.2783000      -1.982600       1.697900    
 H   -4.941000       1.302600      0.3611000    
 H   -3.374700     -0.7247000      -1.097600    
 H   -6.464000     -0.4162000       1.318800    
 H   -5.410000      -1.704000      0.7039000    
 H   -4.817800     -0.5971000       1.946700    
 H   -5.430000      0.9231000      -2.044000    
 H   -6.830400      0.5033000      -1.041600    
 H   -5.803800     -0.7738000      -1.722000    
 H    5.688400     -0.7869000      -1.327300    
 H    6.794400      0.1025000     -0.3346000    


%chk=000117193-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000117193

0 1
O -1.275924 0.101211 -0.384867
O 3.612528 -0.157551 -0.318194
O -2.529354 1.238504 1.264889
O 4.970840 1.210893 1.041664
N -3.548478 -0.001011 -0.453024
N 5.872598 -0.341659 -0.474260
C 1.166706 -0.071131 -0.442644
C 1.075744 -1.626637 -0.343004
C -0.037716 0.610577 0.249393
C 2.415395 0.470109 0.292466
C 1.216391 0.341285 -1.937193
C 0.980440 -2.217864 1.080708
C -2.477433 0.510920 0.238351
C -4.944241 0.217737 -0.010020
C 4.845577 0.320473 0.165224
C -5.333943 -0.761536 1.122642
C -5.882531 0.104300 -1.227651
H 0.190846 -1.944513 -0.925684
H 1.965657 -2.043816 -0.850755
H -0.076561 0.393663 1.332682
H -0.001600 1.709843 0.122190
H 2.402978 0.226582 1.371214
H 2.499926 1.568701 0.190066
H 2.086544 -0.119945 -2.435052
H 1.301745 1.439364 -2.046700
H 0.296934 0.016599 -2.453841
H 1.862225 -1.963642 1.697004
H 0.925405 -3.320810 1.029531
H 0.076739 -1.869792 1.613283
H -4.985587 1.246439 0.394112
H -3.358592 -0.601513 -1.256645
H -6.355172 -0.544655 1.486478
H -5.307507 -1.807854 0.765196
H -4.636784 -0.659024 1.971915
H -5.610445 0.832991 -2.011835
H -6.925689 0.296467 -0.922478
H -5.845685 -0.913011 -1.664340
H 5.674162 -1.051694 -1.174504
H 6.829660 -0.103899 -0.231018


