%chk=000091206.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091206

0 1
 O   0.8387000       2.113100      0.2527000    
 O   -4.763800     -0.7551000     -0.1452000    
 O   -8.239400     -0.4656000      7.6600000E-02
 O   -6.938800      -2.182400     -0.3689000    
 N    4.609700      0.2551000     -0.3620000    
 N    7.213100     -0.7624000      0.3764000    
 N  -0.2469000      0.1039000     -0.1522000    
 N   -1.473700      0.6457000      2.3800001E-02
 N   -7.084500     -0.9572000     -8.6300001E-02
 C    4.754500     -0.8334000      0.6122000    
 C    5.789100       1.128800     -0.3327000    
 C    6.033200      -1.635500      0.3475000    
 C    7.068500      0.3275000     -0.5965000    
 C    3.390500       1.020100     -0.1086000    
 C    2.151300      0.1417000     -0.2519000    
 C    8.431700      -1.528000      0.1208000    
 C   0.8659000      0.9154000     -1.8300001E-02
 C   -2.446300     -0.1955000     -0.1230000    
 C   -3.835800      0.2028000      2.8500000E-02
 C   -4.379100       1.409100      0.3237000    
 C   -5.960200     -0.1400000      4.6300001E-02
 C   -5.777600       1.191900      0.3372000    
 H    3.937400      -1.556300      0.5361000    
 H    4.764100     -0.4462000       1.640000    
 H    5.870100       1.645600      0.6333000    
 H    5.700200       1.899100      -1.108400    
 H    6.124500      -2.405800       1.123000    
 H    5.952400      -2.152400     -0.6187000    
 H    7.053900     -6.3199997E-02  -1.623100    
 H    7.924300       1.009100     -0.5190000    
 H    3.317300       1.840900     -0.8340000    
 H    3.411700       1.481700      0.8879000    
 H    2.135400     -0.6683000      0.4844000    
 H    2.109700     -0.3022000      -1.254000    
 H    9.313200     -0.8808000      0.1881000    
 H    8.425400      -2.000400     -0.8682000    
 H    8.558800      -2.311400      0.8761000    
 H  -0.1823000     -0.8839000     -0.3786000    
 H   -2.267800      -1.258700     -0.3703000    
 H   -3.859400       2.338300      0.5091000    
 H   -6.550900       1.920600      0.5355000    


%chk=000091206-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091206

0 1
O 0.765978 2.054212 -0.522756
O -4.928213 -0.763348 0.165779
O -8.435976 -0.044984 0.322857
O -7.303339 -2.046108 0.461052
N 4.643468 0.199774 -0.188065
N 7.338807 -0.739799 0.350509
N -0.285689 -0.024322 -0.224185
N -1.549971 0.503955 -0.200360
N -7.349686 -0.760351 0.327153
C 4.890402 -1.037563 0.596775
C 5.774576 1.148773 -0.007822
C 6.217245 -1.689923 0.174437
C 7.097779 0.493512 -0.434836
C 3.339318 0.831326 0.115347
C 2.161307 0.021952 -0.469706
C 8.648534 -1.350973 0.055986
C 0.851688 0.809730 -0.406624
C -2.560893 -0.331572 -0.038219
C -3.903479 0.193386 -0.004650
C -4.465807 1.476498 -0.103103
C -6.123598 -0.037181 0.168782
C -5.882383 1.327022 0.007830
H 4.069248 -1.755909 0.418654
H 4.929300 -0.818292 1.694104
H 5.866713 1.479015 1.057057
H 5.587018 2.042387 -0.631454
H 6.404572 -2.580604 0.803524
H 6.128130 -2.030233 -0.889851
H 7.055351 0.279730 -1.533835
H 7.931040 1.198243 -0.254515
H 3.316993 1.833947 -0.347133
H 3.183585 0.977581 1.214630
H 2.054658 -0.957381 0.035344
H 2.396296 -0.185715 -1.532873
H 9.453534 -0.623283 0.263606
H 8.752151 -1.687690 -1.007129
H 8.805196 -2.228430 0.709028
H -0.134002 -1.040658 -0.120505
H -2.458538 -1.426824 0.075954
H -3.899023 2.394397 -0.238280
H -6.644185 2.101404 -0.023204


