%chk=000018822.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000018822

0 1
 O   0.1713000       2.214300      7.7000000E-03
 O   -2.083300       2.557900     -3.2600001E-02
 O    5.728200     -0.7378000      6.3000000E-03
 O    4.385800      -2.474800     -1.0300000E-02
 N    4.576100      -1.234600     -1.0000000E-03
 N   -5.312100      -1.317700      1.6899999E-02
 C    1.052700     -4.7499999E-02 -4.4000000E-03
 C   -1.357700      0.2919000     -1.4500000E-02
 C    1.262700       1.326100      6.8999999E-03
 C  -0.3119000     -0.5487000     -9.3999999E-03
 C    2.160100     -0.8991000     -6.3999998E-03
 C   -2.723300     -0.2652000     -3.8000001E-03
 C    2.544400       1.872700      1.5500000E-02
 C    3.452300     -0.3661000      1.9000000E-03
 C   -1.146800       1.765600     -1.1500000E-02
 C    3.643700       1.017200      1.2800000E-02
 C   -3.364400     -0.5160000       1.203900    
 C   -3.374100     -0.5395000      -1.201100    
 C   -4.647300      -1.038000       1.160300    
 C   -4.656400      -1.060400      -1.137100    
 H  -0.4516000      -1.626200     -6.0999999E-03
 H    1.994500      -1.974500     -1.4400000E-02
 H    2.690500       2.948500      2.3700001E-02
 H    4.635600       1.461700      1.9400001E-02
 H   -2.888600     -0.3135000       2.158000    
 H   -2.905900     -0.3557000      -2.162700    
 H   -5.191300      -1.251400       2.074500    
 H   -5.207800      -1.291500      -2.042600    


%chk=000018822-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000018822

0 1
O 0.240797 2.118651 0.665778
O -1.996210 2.517878 0.953158
O 5.833140 -0.649438 -0.483598
O 4.436469 -2.398500 -0.931070
N 4.658838 -1.176839 -0.576760
N -5.415487 -1.335477 -0.135191
C 1.080812 -0.063460 -0.045020
C -1.373457 0.272855 0.181228
C 1.307334 1.290352 0.350088
C -0.283120 -0.532920 -0.112257
C 2.203155 -0.876249 -0.348161
C -2.766629 -0.240179 0.070255
C 2.608048 1.835569 0.440350
C 3.489728 -0.323467 -0.255733
C -1.152217 1.670471 0.622134
C 3.710274 1.024238 0.134483
C -3.822265 0.212595 0.908539
C -3.086685 -1.246318 -0.884945
C -5.105674 -0.360588 0.771086
C -4.399604 -1.756637 -0.947602
H -0.452186 -1.579065 -0.390700
H 2.084391 -1.920256 -0.652913
H 2.728122 2.877704 0.747058
H 4.734168 1.402157 0.189432
H -3.654314 0.997855 1.647745
H -2.338147 -1.608024 -1.597952
H -5.930437 -0.027623 1.410545
H -4.663448 -2.527586 -1.680081


