%chk=000059567.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059567

0 1
 O    1.914000     -0.1384000     -0.1596000    
 O  -0.9318000      -2.905900      0.8461000    
 O    1.613100      -2.417600     -4.2599998E-02
 N    5.412100      0.9482000      0.2725000    
 N   -8.404200       2.299300      0.6576000    
 C   -4.937100      0.8627000      1.2300000E-02
 C   -4.372400     -3.9299998E-02  -1.087300    
 C    3.979400       1.066400      4.5800000E-02
 C   -6.419400       1.162100     -0.2223000    
 C   -2.921500     -0.3693000     -0.8468000    
 C    6.041500       2.270500      0.3113000    
 C    6.034800      0.1224000     -0.7651000    
 C    3.320600     -0.3038000      4.9100000E-02
 C   -6.990400       2.033400      0.8952000    
 C   -2.591800      -1.494200     -0.1055000    
 C   -1.939200      0.4574000      -1.371500    
 C  -0.2512000     -0.9763000     -0.4059000    
 C   -1.249000      -1.799400      0.1162000    
 C  -0.5964000      0.1521000      -1.149700    
 C    5.412300       3.146900       1.381000    
 C    7.519100     -6.4900003E-02 -0.5003000    
 C    1.156600      -1.276800     -0.1862000    
 C  -0.7992000      -2.735500       2.255600    
 H   -4.812400      0.3797000      0.9898000    
 H   -4.373400       1.803400      5.0799999E-02
 H   -4.482700      0.4454000      -2.066000    
 H   -4.953100     -0.9688000      -1.148900    
 H    3.483300       1.637900      0.8379000    
 H    3.752500       1.585000     -0.8956000    
 H   -6.540500       1.666700      -1.189100    
 H   -6.976800      0.2184000     -0.2784000    
 H    7.098800       2.186200      0.5825000    
 H    5.986600       2.778700     -0.6597000    
 H    5.632000     -0.8936000     -0.7601000    
 H    5.882600      0.5376000      -1.769100    
 H    3.485800     -0.8125000       1.006500    
 H    3.670200     -0.9380000     -0.7694000    
 H   -6.451200       2.985100      0.9508000    
 H   -6.878500       1.534800       1.863900    
 H   -3.367500      -2.136400      0.3035000    
 H   -2.198200       1.337500      -1.953100    
 H   0.1568000      0.8062000      -1.581200    
 H    4.430200       3.529000       1.085700    
 H    5.319700       2.620400       2.337200    
 H    6.046100       4.024300       1.553600    
 H    8.102000      0.8318000     -0.7317000    
 H    7.713400     -0.3588000      0.5370000    
 H    7.909000     -0.8625000      -1.143100    
 H   -8.519700       2.753700     -0.2476000    
 H   -8.912600       1.417800      0.5946000    
 H   -1.756600      -2.437700       2.694900    
 H  -3.2299999E-02  -1.990200       2.488900    
 H  -0.4986000      -3.693100       2.689400    


%chk=000059567-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000059567

0 1
O 1.909348 0.054893 0.249312
O -1.242046 -2.824496 1.505404
O 1.682249 -2.225425 0.637572
N 5.485910 1.109250 -0.090267
N -8.805486 2.379585 -0.042427
C -5.211163 0.803476 -0.134200
C -4.467578 -0.201732 -1.059421
C 4.007442 1.225526 -0.056808
C -6.664867 1.068818 -0.584860
C -3.027553 -0.431373 -0.631323
C 6.189104 2.320419 0.408846
C 5.996072 0.629858 -1.404564
C 3.387204 -0.128646 0.308954
C -7.412559 2.070797 0.338022
C -2.680689 -1.517652 0.194205
C -2.003075 0.486566 -1.000686
C -0.307991 -0.844266 0.219629
C -1.352035 -1.727970 0.649904
C -0.682639 0.277167 -0.584170
C 6.115715 2.466175 1.940607
C 7.341455 -0.112632 -1.294049
C 1.141067 -1.110351 0.414408
C -0.268745 -2.850111 2.612252
H -5.204968 0.411825 0.903009
H -4.648032 1.758436 -0.108832
H -4.493664 0.189973 -2.095757
H -5.022049 -1.159839 -1.061951
H 3.712331 1.965818 0.707193
H 3.584209 1.578827 -1.027026
H -6.667022 1.464122 -1.622809
H -7.228982 0.112642 -0.611643
H 7.251070 2.234898 0.115398
H 5.800316 3.249939 -0.079908
H 5.245473 -0.065887 -1.824249
H 6.085865 1.472634 -2.136111
H 3.678386 -0.438277 1.327466
H 3.679455 -0.931445 -0.391848
H -6.848129 3.023280 0.373961
H -7.419944 1.677149 1.373292
H -3.440442 -2.228753 0.536250
H -2.246033 1.348083 -1.633311
H 0.110795 0.959772 -0.899354
H 5.074067 2.570324 2.295373
H 6.553486 1.577215 2.426948
H 6.671866 3.363417 2.270917
H 8.141203 0.538221 -0.896678
H 7.241673 -0.979173 -0.617802
H 7.666682 -0.472448 -2.288134
H -8.895323 2.860679 -0.943182
H -9.443623 1.579958 0.022263
H -0.119986 -1.834833 3.027361
H 0.694934 -3.252909 2.265973
H -0.727954 -3.503525 3.370755


