%chk=000060461.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060461

0 1
 O   -6.161900      0.7676000     -0.8984000    
 O    6.160000      0.7797000      0.8953000    
 N   -11.07140      -1.092600      0.9354000    
 N    11.06960      -1.118000     -0.8994000    
 C   6.8000001E-03 -9.9600002E-02 -1.5900001E-02
 C   -1.271200      0.7220000     -0.2164000    
 C    1.264900      0.7605000      0.1299000    
 C   -2.534600     -0.1336000     -0.3404000    
 C    2.542200     -6.1999999E-02  0.3297000    
 C   -3.774500      0.7404000     -0.5581000    
 C    3.789000      0.7924000      0.5529000    
 C   -5.043200     -8.8500001E-02 -0.7187000    
 C    5.036000     -6.8700001E-02  0.7061000    
 C   -7.372000      0.3087000     -0.4454000    
 C    7.369700      0.3116000      0.4521000    
 C   -7.628600      -1.057200     -0.4335000    
 C    7.616200      -1.056300      0.4421000    
 C   -8.329200       1.214900     -4.4999998E-03
 C    8.337600       1.210400      1.8700000E-02
 C   -8.860300      -1.523700      2.5800001E-02
 C    8.848000      -1.532300     -7.4000000E-03
 C   -9.560800      0.7482000      0.4548000    
 C    9.569300      0.7343000     -0.4308000    
 C   -9.826300     -0.6211000      0.4700000    
 C    9.824400     -0.6371000     -0.4439000    
 H  -0.1062000     -0.7256000      0.8778000    
 H   0.1326000     -0.7811000     -0.8662000    
 H   -1.386900       1.414500      0.6267000    
 H   -1.160600       1.337200      -1.118000    
 H    1.137300       1.438000      0.9833000    
 H    1.378800       1.390800     -0.7605000    
 H   -2.661400     -0.7358000      0.5670000    
 H   -2.423600     -0.8300000      -1.180100    
 H    2.691100     -0.7032000     -0.5480000    
 H    2.407400     -0.7298000       1.189700    
 H   -3.898900       1.433600      0.2834000    
 H   -3.642400       1.370100      -1.446900    
 H    3.664600       1.419500       1.444300    
 H    3.926100       1.486000     -0.2860000    
 H   -5.147100     -0.7048000      0.1841000    
 H   -4.950800     -0.7432000      -1.593100    
 H    5.135800     -0.6768000     -0.2025000    
 H    4.932500     -0.7275000       1.576200    
 H   -6.915800      -1.790600     -0.7979000    
 H    6.894600      -1.784200      0.8000000    
 H   -8.126100       2.282000     -1.4900000E-02
 H    8.142700       2.279000      2.7500000E-02
 H   -9.058000      -2.592600      2.6900001E-02
 H    9.037600      -2.602700     -7.1999999E-03
 H   -10.30540       1.461700      0.7986000    
 H    10.32200       1.442000     -0.7686000    
 H   -11.26520      -2.085100      0.9455000    
 H   -11.77260     -0.4384000       1.256200    
 H    11.25590      -2.112000     -0.9078000    
 H    11.77830     -0.4691000      -1.214600    


%chk=000060461-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060461

0 1
O -6.271808 0.843509 0.055279
O 6.272378 0.842376 -0.071101
N -11.616274 -1.040707 0.142599
N 11.617029 -1.042630 -0.121797
C 0.000203 -0.128073 -0.007713
C -1.288513 0.724291 0.001612
C 1.289055 0.724025 -0.022336
C -2.582418 -0.120469 0.017757
C 2.582858 -0.121001 -0.031635
C -3.859917 0.749668 0.026928
C 3.860454 0.748926 -0.046078
C -5.138310 -0.091996 0.047020
C 5.138816 -0.092967 -0.056141
C -7.571313 0.289680 0.077186
C 7.571916 0.288337 -0.083240
C -7.863940 -1.095135 0.091437
C 7.864549 -1.096548 -0.081883
C -8.635594 1.223628 0.084843
C 8.636237 1.222161 -0.097639
C -9.207118 -1.534391 0.113051
C 9.207780 -1.535990 -0.094611
C -9.970934 0.785502 0.106307
C 9.971626 0.783851 -0.110309
C -10.283165 -0.606504 0.120876
C 10.283870 -0.608228 -0.108971
H 0.008347 -0.791242 0.882682
H -0.008029 -0.796858 -0.893885
H -1.278785 1.393781 0.886770
H -1.296142 1.386983 -0.888664
H 1.296240 1.392914 0.863296
H 1.279952 1.387319 -0.912152
H -2.574957 -0.782161 0.909302
H -2.592452 -0.789530 -0.868217
H 2.575972 -0.789054 -0.918409
H 2.592164 -0.783685 0.859138
H -3.858124 1.414971 0.911760
H -3.878434 1.404135 -0.865747
H 3.877303 1.411205 0.840852
H 3.860415 1.406449 -0.936708
H -5.173888 -0.735649 0.952675
H -5.195590 -0.746071 -0.850005
H 5.176032 -0.745038 -0.955681
H 5.194372 -0.738631 0.847069
H -7.064245 -1.842039 0.086013
H 7.064822 -1.843363 -0.071121
H -8.394944 2.291503 0.073626
H 8.395576 2.290092 -0.098627
H -9.418786 -2.610887 0.123994
H 9.419457 -2.612539 -0.093374
H -10.781725 1.524559 0.111932
H 10.782444 1.522818 -0.121372
H -11.841342 -2.030234 0.152303
H -12.380075 -0.372482 0.146648
H 11.842101 -2.032201 -0.119900
H 12.380856 -0.374481 -0.130739


