%chk=000173316.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173316

0 1
 O    6.385800       2.110000      0.1236000    
 O   -6.015800       1.397600     -5.5700000E-02
 N   -5.125600      -1.341000     -0.1208000    
 N   -5.771600      -2.193400     -5.9700001E-02
 C    2.531200     -2.2600001E-02  0.1846000    
 C    1.543800      -1.126100     -0.2544000    
 C   0.1193000     -0.8885000      0.2584000    
 C  -0.3899000      0.4769000     -0.3069000    
 C   -1.871900      0.7697000      0.1269000    
 C    3.829500     -0.5929000     -0.4369000    
 C    2.054300       1.304400     -0.4229000    
 C   0.6054000       1.630600     -1.5400000E-02
 C    2.261700      -2.419400      0.1189000    
 C  -0.8207000      -2.037200     -0.1295000    
 C    3.749400      -2.106500     -0.1269000    
 C   -2.754000     -0.4239000     -0.3617000    
 C   -2.277900      -1.757100      0.2397000    
 C    2.669500      0.1300000       1.720400    
 C   -2.424900       2.026200     -0.5874000    
 C    5.138000      3.6200002E-02  1.9500000E-02
 C   -1.966800      0.9834000       1.661100    
 C   -4.240000     -0.1725000     -0.2037000    
 C   -3.907700       2.291300     -0.2787000    
 C    5.152000       1.537600     -0.2899000    
 C   -4.804000       1.057600     -0.1704000    
 C    6.331000     -0.6703000     -0.6320000    
 H    1.484700      -1.120900      -1.355900    
 H   0.1423000     -0.8517000       1.351800    
 H  -0.4018000      0.3749000      -1.404000    
 H    3.764800     -0.4847000      -1.530900    
 H    2.108000       1.258100      -1.518200    
 H    2.636600       2.170700     -0.1194000    
 H   0.5814000       1.895300       1.046400    
 H   0.3027000       2.529200     -0.5643000    
 H    1.927400      -3.264300     -0.4919000    
 H    2.094500      -2.683000       1.169200    
 H  -0.5044000      -2.964300      0.3630000    
 H  -0.7561000      -2.218800      -1.210200    
 H    4.329500      -2.381900      0.7612000    
 H    4.133200      -2.693700     -0.9687000    
 H   -2.610200     -0.5205000      -1.450200    
 H   -2.880400      -2.589700     -0.1424000    
 H   -2.399300      -1.761400       1.329200    
 H    3.336300      0.9576000       1.982700    
 H    1.715100      0.3418000       2.209700    
 H    3.071600     -0.7707000       2.194900    
 H   -2.307600       1.910500      -1.673600    
 H   -1.856800       2.922000     -0.3115000    
 H    5.271300     -9.2100002E-02   1.101200    
 H   -1.478100       1.917100       1.959300    
 H   -3.001400       1.044700       2.012300    
 H   -1.500200      0.1764000       2.230800    
 H   -4.283300       2.971500      -1.057700    
 H   -3.960100       2.850400      0.6678000    
 H    4.982600       1.762000      -1.347500    
 H    4.433900       2.069100      0.3224000    
 H    6.306500     -0.5628000      -1.721900    
 H    6.351300      -1.739000     -0.3978000    
 H    7.281400     -0.2605000     -0.2747000    
 H    7.046100       1.913400     -0.5622000    


%chk=000173316-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000173316

0 1
O 6.641454 2.137541 0.127863
O -6.168238 1.299308 -0.214763
N -5.112916 -1.228861 -0.038151
N -5.950491 -2.049641 0.095539
C 2.546322 0.020657 0.206688
C 1.540695 -1.102842 -0.221236
C 0.097528 -0.889567 0.280426
C -0.434073 0.466054 -0.293234
C -1.929097 0.754398 0.116926
C 3.870729 -0.551200 -0.430289
C 2.008822 1.347820 -0.393484
C 0.541475 1.629495 0.036248
C 2.269250 -2.419051 0.134015
C -0.825337 -2.067355 -0.114083
C 3.772413 -2.099701 -0.153839
C -2.775971 -0.476673 -0.364504
C -2.299694 -1.808000 0.262267
C 2.697290 0.133585 1.747628
C -2.477531 1.989323 -0.660688
C 5.244972 0.032972 0.010316
C -2.067917 0.991094 1.644933
C -4.272711 -0.207399 -0.175747
C -3.949741 2.317667 -0.325457
C 5.333326 1.561908 -0.224044
C -4.910032 1.125883 -0.251512
C 6.401687 -0.682536 -0.734189
H 1.496385 -1.054982 -1.335629
H 0.113974 -0.832521 1.389408
H -0.435669 0.350717 -1.404018
H 3.781883 -0.393095 -1.530082
H 2.057425 1.283347 -1.501516
H 2.629142 2.213934 -0.096727
H 0.515956 1.841922 1.122674
H 0.208171 2.555795 -0.468659
H 1.905837 -3.275283 -0.461368
H 2.113378 -2.676971 1.199343
H -0.473730 -2.998586 0.368889
H -0.753993 -2.230900 -1.211078
H 4.407264 -2.375202 0.710202
H 4.145492 -2.677910 -1.017818
H -2.588619 -0.559309 -1.460966
H -2.926460 -2.647109 -0.099426
H -2.417911 -1.772943 1.362859
H 3.409684 0.936430 2.011658
H 1.741785 0.373012 2.244409
H 3.075818 -0.803548 2.193345
H -2.376192 1.795546 -1.748610
H -1.866187 2.883197 -0.439044
H 5.377182 -0.149999 1.096717
H -1.667470 1.982732 1.923374
H -3.123886 0.955149 1.966415
H -1.522058 0.235644 2.235473
H -4.374614 3.028725 -1.057891
H -4.017893 2.824916 0.657637
H 5.073171 1.792832 -1.282189
H 4.634012 2.102269 0.431684
H 6.357041 -0.481233 -1.823619
H 6.354762 -1.775543 -0.594260
H 7.388868 -0.356854 -0.356006
H 7.326836 1.785741 -0.493709


