%chk=000059436.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059436

0 1
 N  -0.5800000     -0.2231000      0.2086000    
 N    3.133800      4.8000002E-03 -9.4300002E-02
 N   -2.748800     -0.5046000     -0.1877000    
 C   -1.365800      -2.569000     -7.3799998E-02
 C   -1.594100      -1.110200     -2.2800000E-02
 C   0.8100000     -0.5517000      0.4317000    
 C   -1.115900       1.039100      0.1924000    
 C    1.744700      0.3520000     -0.3672000    
 C   -2.687000      -3.368100     -0.3554000    
 C  -0.7759000      -3.125800       1.269800    
 C  -0.3620000      -3.063400      -1.180300    
 C   -2.470600      0.8366000     -5.6899998E-02
 C    3.435800      0.1652000       1.329200    
 C    4.038900      0.8261000     -0.9005000    
 C  -0.5494000       2.301900      0.3689000    
 C   -3.325600       1.948700     -0.1382000    
 C   -1.415000       3.397400      0.2849000    
 C   -2.778700       3.226100      3.5799999E-02
 C    4.862000     -0.2570000       1.639000    
 C    3.743600      0.6751000      -2.383100    
 H   0.9193000     -0.4180000       1.512300    
 H    1.054000      -1.572200      0.1961000    
 H    1.495900      0.1688000      -1.419200    
 H    1.640800       1.415600     -0.2090000    
 H   -2.521000      -4.451200     -0.3460000    
 H   -3.443900      -3.143500      0.4053000    
 H   -3.105000      -3.095700      -1.331600    
 H   -1.432100      -2.852700       2.105500    
 H  -0.7273000      -4.221500       1.242000    
 H   0.2247000      -2.780700       1.527600    
 H  -0.5512000      -4.113300      -1.437800    
 H  -0.4901000      -2.478000      -2.098200    
 H   0.6924000      -3.033300     -0.9047000    
 H    3.266400       1.193100       1.673700    
 H    2.822500     -0.4970000       1.945200    
 H    3.991900       1.886400     -0.6214000    
 H    5.074900      0.4962000     -0.7714000    
 H   0.4646000       2.487600      0.6890000    
 H   -4.386800       1.826000     -0.3297000    
 H   -1.024400       4.399400      0.4453000    
 H   -3.427600       4.096600     -1.7000001E-02
 H    5.102500      -1.230800       1.198600    
 H    5.598800      0.4784000       1.301700    
 H    4.990400     -0.3496000       2.723600    
 H    3.644500     -0.3763000      -2.674500    
 H    2.844000       1.218200      -2.689000    
 H    4.571500       1.096200      -2.965100    


%chk=000059436-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059436

0 1
N -0.576459 -0.140002 0.403430
N 3.199542 0.158365 -0.021279
N -2.741763 -0.382503 -0.304993
C -1.324517 -2.458155 -0.573232
C -1.547454 -0.997387 -0.182620
C 0.857824 -0.349600 0.672463
C -1.216953 1.087680 0.656628
C 1.772364 0.323652 -0.385265
C -2.622258 -2.986234 -1.244151
C -1.053190 -3.315150 0.702515
C -0.156655 -2.619797 -1.591974
C -2.567425 0.917748 0.209412
C 3.675079 1.210670 0.920365
C 4.094943 -0.017844 -1.197813
C -0.760246 2.292635 1.232020
C -3.493211 1.978394 0.328917
C -1.699271 3.340521 1.347632
C -3.044887 3.187502 0.900735
C 4.861948 0.753288 1.788814
C 3.986829 -1.416103 -1.834716
H 1.084332 0.060900 1.674697
H 1.087283 -1.423308 0.709732
H 1.586509 -0.152934 -1.363129
H 1.485887 1.396261 -0.496128
H -2.487148 -4.052198 -1.507933
H -3.487238 -2.885872 -0.569030
H -2.856272 -2.416545 -2.159357
H -1.900161 -3.234437 1.406885
H -0.941806 -4.377837 0.417619
H -0.135122 -3.012152 1.236859
H -0.115535 -3.670940 -1.932344
H -0.320728 -1.981302 -2.479168
H 0.828751 -2.374801 -1.160823
H 3.942453 2.150571 0.374246
H 2.832573 1.471042 1.589111
H 3.908406 0.767614 -1.973070
H 5.134065 0.127242 -0.850946
H 0.270293 2.424163 1.580140
H -4.524935 1.851143 -0.013113
H -1.387530 4.293426 1.789999
H -3.740553 4.027164 1.007055
H 4.584894 -0.143070 2.370380
H 5.747462 0.501085 1.178175
H 5.158256 1.555400 2.490235
H 4.222837 -2.193468 -1.087181
H 2.973729 -1.616549 -2.229051
H 4.694756 -1.509478 -2.679349


