%chk=000119330.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000119330

0 1
 O    2.276600      -2.435300     -0.4226000    
 O   -7.689600       4.771300      -1.573800    
 O    9.636600       2.685200     -0.4328000    
 N   -2.604000      0.2040000      0.8491000    
 N   -2.890800      -1.107500      0.6293000    
 N    2.855800      0.2926000      3.5599999E-02
 N   -5.395300       2.629900      0.3482000    
 N    6.005400       2.226900     -4.8400000E-02
 C  -0.6904000     -0.6742000      0.3814000    
 C   -1.277900      0.5227000      0.7112000    
 C   0.6702000     -0.8051000      0.1479000    
 C   -1.698800      -1.639600      0.3407000    
 C   -1.334300      -3.005200      9.9999998E-03
 C    1.463500      0.3329000      0.2553000    
 C   -3.674300       1.110500       1.194200    
 C   4.2399999E-02  -3.275400     -0.2541000    
 C    1.101500      -2.183200     -0.1949000    
 C  -0.5223000       1.688300      0.8302000    
 C   0.8647000       1.560700      0.5931000    
 C   -4.305600       1.744100     -4.2100001E-02
 C   -2.275900      -4.032700     -5.4900002E-02
 C   0.4386000      -4.575200     -0.5774000    
 C    3.692800       1.447700      0.1405000    
 C    5.140900       1.055900     -0.1241000    
 C   -1.861000      -5.325000     -0.3795000    
 C  -0.5145000      -5.594100     -0.6387000    
 C   -6.017100       3.235800     -0.8210000    
 C    7.392100       1.867500     -0.3101000    
 C   -7.123900       4.191800     -0.4054000    
 C    8.294700       3.084700     -0.1869000    
 H   -4.416800      0.5408000       1.766800    
 H   -3.264800       1.874100       1.865800    
 H  -0.9651000       2.643200       1.087400    
 H    1.447600       2.474300      0.6858000    
 H   -4.682300      0.9531000     -0.7028000    
 H   -3.542300       2.300600     -0.6005000    
 H    3.263700     -0.6021000     -0.2109000    
 H   -3.328500      -3.848600      0.1421000    
 H    3.621600       1.883100       1.145300    
 H    3.387600       2.207600     -0.5900000    
 H    1.477400      -4.816300     -0.7844000    
 H    5.455200      0.3009000      0.6079000    
 H    5.215900      0.5986000      -1.118900    
 H   -5.040800       3.358200      0.9676000    
 H   -2.590500      -6.128700     -0.4313000    
 H  -0.2066000      -6.605400     -0.8902000    
 H   -5.277400       3.784700      -1.417700    
 H   -6.439300       2.465000      -1.477700    
 H    5.927300       2.653000      0.8747000    
 H    7.498800       1.444700      -1.316900    
 H    7.735900       1.096400      0.3910000    
 H   -6.734100       4.998300      0.2248000    
 H   -7.915100       3.666000      0.1396000    
 H    8.021600       3.853500     -0.9175000    
 H    8.242400       3.515700      0.8186000    
 H   -8.392600       5.375800      -1.280500    
 H    10.19060       3.479900     -0.3485000    


%chk=000119330-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000119330

0 1
O 2.400334 -2.307011 -0.356917
O -8.523613 4.161064 -1.528745
O 9.910427 2.472349 -0.679267
N -2.608754 0.489963 0.893853
N -2.901922 -0.847712 0.597566
N 2.941011 0.316591 0.203111
N -5.505171 2.811200 0.180967
N 6.340582 1.909691 0.209703
C -0.644267 -0.463499 0.427062
C -1.235267 0.765810 0.789278
C 0.729654 -0.670170 0.221317
C -1.682784 -1.424930 0.317550
C -1.329965 -2.788734 -0.045509
C 1.590259 0.468833 0.397778
C -3.713766 1.415491 1.156120
C 0.073536 -3.060833 -0.273761
C 1.150510 -2.018869 -0.147715
C -0.396091 1.898980 0.973601
C 0.988171 1.733972 0.776961
C -4.438783 1.844461 -0.142229
C -2.278534 -3.836821 -0.184565
C 0.464251 -4.377699 -0.635086
C 3.936066 1.379641 0.354769
C 5.331470 0.864969 -0.048530
C -1.862487 -5.131508 -0.543156
C -0.486627 -5.404328 -0.770170
C -6.483717 3.057374 -0.902533
C 7.689574 1.626355 -0.329521
C -7.653806 3.893998 -0.372679
C 8.579636 2.866346 -0.191198
H -4.437792 0.929020 1.829569
H -3.298532 2.298117 1.677823
H -0.788698 2.880822 1.258877
H 1.639435 2.602129 0.916658
H -4.901569 0.947102 -0.590818
H -3.686977 2.225385 -0.876142
H 3.219120 -0.653000 -0.052665
H -3.336217 -3.616925 -0.007443
H 3.965210 1.736541 1.409051
H 3.686169 2.254857 -0.277191
H 1.530469 -4.560648 -0.803345
H 5.536260 -0.097637 0.484101
H 5.336891 0.638647 -1.131629
H -5.118868 3.694344 0.544722
H -2.602430 -5.932839 -0.648193
H -0.168476 -6.414397 -1.049911
H -6.051468 3.574961 -1.791140
H -6.871392 2.082921 -1.250826
H 6.380155 2.150450 1.210871
H 7.592841 1.376448 -1.401935
H 8.199836 0.765060 0.162638
H -7.275381 4.845950 0.064449
H -8.182636 3.329166 0.421822
H 8.149964 3.697622 -0.786474
H 8.628099 3.184956 0.874926
H -9.344710 4.623079 -1.226456
H 10.510267 3.259292 -0.679795


