%chk=000051323.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051323

0 1
 N   -7.094500     -4.4999998E-03 -0.5793000    
 N    7.094400      3.5999999E-03 -0.5795000    
 N   -3.551900      6.0000003E-04 -7.0100002E-02
 N    3.551900     -7.9999998E-04 -7.0100002E-02
 N   -4.892300     -3.0000001E-04  0.1236000    
 N    4.892200      3.9999999E-04  0.1236000    
 N   -5.484300      3.5000001E-03  -2.178500    
 N    5.484000     -6.3999998E-03  -2.178600    
 C  -0.7063000       1.225600       1.027200    
 C   0.7057000       1.226000       1.027300    
 C  -0.7056000      -1.224600       1.028300    
 C   0.7065000      -1.224100       1.028500    
 C   -1.393600      3.0000001E-04   1.027700    
 C    1.393800      1.1000000E-03   1.028000    
 C   -1.393700       2.450700       1.026800    
 C    1.392200       2.451700       1.027000    
 C   -1.392100      -2.450200       1.028900    
 C    1.393800      -2.449300       1.029200    
 C   -2.861500       0.000000       1.027200    
 C    2.861400      1.4000000E-03   1.027400    
 C  -0.6967000       3.659100       1.026200    
 C   0.6945000       3.659500       1.026400    
 C  -0.6944000      -3.658200       1.029200    
 C   0.6967000      -3.657600       1.029300    
 C   -7.896300     -6.5000001E-03  -1.764800    
 C    7.896200      4.0000002E-03  -1.765000    
 C   -6.816900      2.4000001E-03  -2.854700    
 C    6.816700     -6.3000000E-03  -2.854800    
 C   -5.769500      9.9999997E-05 -0.8982000    
 C    5.769500     -1.4000000E-03 -0.8983000    
 H   -2.479700       2.502100       1.029700    
 H    2.478200       2.503700       1.030200    
 H   -2.478100      -2.502200       1.031900    
 H    2.479800      -2.500700       1.032500    
 H   -3.336900     -1.4000000E-03   2.026100    
 H    3.337100      4.4000000E-03   2.026100    
 H   -1.240300       4.599400       1.026700    
 H    1.237400       4.600200       1.027000    
 H   -1.237400      -4.598800       1.030500    
 H    1.240300      -4.597900       1.030600    
 H   -8.531600      0.8822000      -1.820900    
 H   -8.520300     -0.9029000      -1.824800    
 H    8.531400     -0.8848000      -1.820000    
 H    8.520200      0.9003000      -1.826200    
 H   -6.905200      0.8926000      -3.486500    
 H   -6.899700     -0.8818000      -3.495700    
 H    6.899400      0.8770000      -3.496900    
 H    6.904900     -0.8974000      -3.485400    
 H   -7.477500     -9.3000000E-03  0.3579000    
 H    7.477500      9.4999997E-03  0.3577000    
 H   -5.247600     -2.9000000E-03   1.076100    
 H    5.247700      4.1999999E-03   1.076000    


%chk=000051323-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051323

0 1
N -7.482872 -0.513584 0.111441
N 7.482318 0.507722 0.139154
N -3.871002 -0.040871 -0.187245
N 3.870842 0.040753 -0.178160
N -5.094108 -0.607828 0.087862
N 5.093472 0.599828 0.114759
N -6.295432 1.495160 0.085415
N 6.297100 -1.500991 0.047830
C -1.018023 1.035116 -0.228274
C 0.399843 1.379992 -0.256207
C -0.399878 -1.376274 -0.300398
C 1.017827 -1.032591 -0.259170
C -1.415054 -0.351884 -0.195704
C 1.414932 0.352674 -0.182225
C -1.985228 2.106250 -0.226580
C 0.751186 2.775524 -0.370162
C -0.751427 -2.767319 -0.459752
C 1.984844 -2.103533 -0.289582
C -2.799007 -0.793711 0.004953
C 2.798495 0.787962 0.033705
C -1.596113 3.441004 -0.293030
C -0.211360 3.780715 -0.389012
C 0.210916 -3.771639 -0.508915
C 1.595520 -3.435378 -0.399328
C -8.568807 0.501123 0.022911
C 8.569030 -0.502816 0.014925
C -7.751427 1.854324 0.052577
C 7.753531 -1.857320 0.008179
C -6.249148 0.183276 0.075890
C 6.249145 -0.189648 0.079798
H -3.045725 1.849276 -0.199810
H 1.799034 3.063063 -0.491378
H -1.799189 -3.050116 -0.592394
H 3.045308 -1.847801 -0.252021
H -2.924275 -1.828046 0.378242
H 2.923557 1.811131 0.436538
H -2.357328 4.228597 -0.294069
H 0.092368 4.828928 -0.489346
H -0.092687 -4.816036 -0.643501
H 2.356580 -4.222750 -0.423997
H -9.264855 0.415671 0.875614
H -9.146191 0.386278 -0.914698
H 9.269442 -0.441984 0.866071
H 9.141272 -0.359296 -0.921964
H -7.992608 2.445017 0.954711
H -7.961101 2.488303 -0.828428
H 7.965760 -2.468504 -0.888116
H 7.993776 -2.470345 0.895623
H -7.587150 -1.407678 -0.373420
H 7.584706 1.415084 -0.321181
H -5.166449 -1.567447 0.459408
H 5.165137 1.547918 0.514959


