%chk=000092440.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000092440

0 1
 O   -3.054400       3.558100     -0.1731000    
 O    7.471100      0.7265000      0.7913000    
 O    7.523900     -0.4129000      -1.084400    
 N   -4.753300     -0.8329000      6.2399998E-02
 N   -1.075300       2.280800     -0.2603000    
 N   0.7463000      0.1116000     -0.3099000    
 N    1.364400     -0.8110000      0.2695000    
 N    6.898200      6.3100003E-02 -0.1065000    
 N    2.124400       1.132300       3.185200    
 N    2.288900      -2.486400      -2.759000    
 C   -5.692800      0.2895000      9.9500000E-02
 C   -5.277700      -2.175200      0.1383000    
 C   -3.375600     -0.5900000     -3.2000002E-02
 C   -5.988400      0.7930000      -1.309500    
 C   -5.212500      -2.700200       1.568800    
 C   -2.901300      0.7199000     -0.1012000    
 C   -2.479300      -1.658600     -5.3900000E-02
 C   -1.530500      0.9613000     -0.1930000    
 C   -6.997100       1.933200      -1.329400    
 C   -5.796500      -4.099000       1.711400    
 C  -0.6344000     -0.1074000     -0.2164000    
 C   -1.108600      -1.417400     -0.1466000    
 C   -1.834200       3.457000     -0.2486000    
 C    2.749300     -0.5910000      0.1751000    
 C  -0.9619000       4.684000     -0.3388000    
 C    3.407700      0.1462000       1.159500    
 C    3.465200      -1.110000     -0.9035000    
 C    5.498200     -0.1561000     -1.2800000E-02
 C    4.782300      0.3633000       1.065800    
 C    4.839700     -0.8922000     -0.9979000    
 C    2.698800      0.6909000       2.278400    
 C    2.815500      -1.870300      -1.928500    
 H   -6.638800     -5.4499999E-02  0.5403000    
 H   -5.371400       1.089700      0.7764000    
 H   -6.329700      -2.174900     -0.1787000    
 H   -4.792000      -2.857200     -0.5695000    
 H   -5.075700       1.127800      -1.813500    
 H   -6.382500     -3.2699998E-02  -1.915600    
 H   -4.180900      -2.715000       1.936800    
 H   -5.762800      -2.021900       2.233200    
 H   -3.601900       1.532700     -8.5800000E-02
 H   -2.785700      -2.697700     -5.7000001E-03
 H   -6.621300       2.794700     -0.7682000    
 H   -7.188500       2.253400      -2.358400    
 H   -7.948500       1.621700     -0.8870000    
 H   -5.246500      -4.815500       1.093100    
 H   -5.737600      -4.430900       2.752700    
 H   -6.847800      -4.116700       1.407200    
 H  -0.4499000      -2.281600     -0.1850000    
 H  -6.4800002E-02   2.385300     -0.3257000    
 H  -0.3719000       4.652900      -1.259200    
 H  -0.2914000       4.724900      0.5241000    
 H   -1.585300       5.582300     -0.3478000    
 H    5.278100      0.9401000       1.844400    
 H    5.380900      -1.305600      -1.846800    


%chk=000092440-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000092440

0 1
O -2.974239 3.545114 0.280128
O 7.594310 1.380735 -0.087310
O 7.942316 -0.872216 -0.268403
N -4.822362 -0.865079 0.021569
N -1.022243 2.241534 0.145367
N 0.702851 0.161604 -0.052579
N 1.557150 -0.863030 -0.152889
N 7.170080 0.161306 -0.174580
N 2.049454 3.058892 0.138223
N 2.928775 -4.064134 -0.429262
C -5.795181 0.236174 0.235958
C -5.400947 -2.220805 -0.143792
C -3.460881 -0.633566 -0.009411
C -6.191325 0.973334 -1.068064
C -5.498699 -3.013891 1.183640
C -2.951676 0.701549 0.079541
C -2.522844 -1.734755 -0.126497
C -1.570257 0.952043 0.064287
C -7.204086 2.103393 -0.788030
C -6.151298 -4.396270 0.972656
C -0.634977 -0.159132 -0.048961
C -1.160386 -1.493279 -0.144798
C -1.708986 3.464317 0.251827
C 2.901795 -0.493698 -0.149905
C -0.804243 4.683896 0.331610
C 3.451022 0.842981 -0.056196
C 3.829996 -1.594966 -0.252974
C 5.714132 -0.065274 -0.166795
C 4.849373 1.042025 -0.065417
C 5.221663 -1.384161 -0.261382
C 2.623834 2.012423 0.048288
C 3.312974 -2.935020 -0.348183
H -6.699014 -0.205364 0.696053
H -5.386326 0.955994 0.967384
H -6.413812 -2.098784 -0.570740
H -4.817189 -2.791319 -0.888321
H -5.284956 1.391692 -1.543016
H -6.620566 0.243365 -1.782438
H -4.487127 -3.131668 1.616101
H -6.086579 -2.425192 1.914629
H -3.611078 1.564848 0.148338
H -2.880616 -2.765182 -0.183725
H -6.770232 2.867162 -0.116751
H -7.495231 2.609367 -1.725134
H -8.125549 1.714365 -0.314862
H -5.567064 -5.014209 0.265353
H -6.215917 -4.950010 1.925547
H -7.176976 -4.300576 0.569500
H -0.440320 -2.313090 -0.223886
H 0.008738 2.284760 0.124339
H -0.139336 4.748516 -0.546857
H -0.145777 4.633663 1.216347
H -1.433941 5.582658 0.389445
H 5.275055 2.046838 0.005387
H 5.922919 -2.218476 -0.339161


