%chk=000026410.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026410

0 1
 O    4.539300      -2.196200      0.5933000    
 O   -2.245300       1.137400      0.6005000    
 O    2.536800      -3.245800     -0.7987000    
 N   -4.850600      0.8061000      3.6899999E-02
 N    4.611700      0.1166000      0.4423000    
 N   -1.640100     -0.9418000     -0.3183000    
 C   -6.216100      0.4950000     -0.3106000    
 C   -7.038900       1.777700     -0.4537000    
 C   -6.835400     -0.4521000      0.7206000    
 C    6.042200      0.2510000      0.6063000    
 C   -8.501500       1.475600     -0.7696000    
 C   -8.297800     -0.7517000      0.4016000    
 C   -9.115700      0.5285000      0.2573000    
 C    6.394100       1.558600       1.323700    
 C    6.763400      0.1455000     -0.7416000    
 C    6.174500       2.787400      0.4413000    
 C    6.543300       1.376600      -1.620700    
 C    6.910900       2.664000     -0.8891000    
 C   -3.955300     -0.2752000     -0.3492000    
 C    3.975100      -1.114700      0.4502000    
 C   -2.532000      8.3600000E-02  4.1600000E-02
 C    2.504300      -1.085200      0.2428000    
 C  -0.2586000     -0.9901000     -0.1308000    
 C    1.846700      -2.150300     -0.3727000    
 C    1.780600      2.7500000E-02  0.6714000    
 C   0.4653000      -2.102800     -0.5593000    
 C   0.3991000      7.5000003E-02  0.4846000    
 H   -6.246200      3.4000000E-03  -1.294000    
 H    6.377200     -0.5823000       1.236500    
 H   -6.625200       2.409400      -1.249700    
 H   -6.987800       2.363100      0.4741000    
 H   -6.772700     -8.1000002E-03   1.723100    
 H   -6.295300      -1.404300      0.7634000    
 H   -9.073200       2.410000     -0.7971000    
 H   -8.574300       1.027500      -1.768300    
 H   -8.727800      -1.375600       1.193400    
 H   -8.357700      -1.330000     -0.5287000    
 H   -9.176000       1.034000       1.229000    
 H   -10.14140      0.2797000     -3.7599999E-02
 H    7.448400       1.526500       1.626800    
 H    5.802500       1.660300       2.241500    
 H    6.437900     -0.7501000      -1.284300    
 H    7.839900      3.1399999E-02 -0.5606000    
 H    6.524200       3.681700      0.9699000    
 H    5.103700       2.932600      0.2566000    
 H    7.145400       1.288100      -2.532200    
 H    5.494300       1.422300      -1.937800    
 H    7.992900       2.684000     -0.7094000    
 H    6.677100       3.527600      -1.521700    
 H   -4.556100       1.656600     -0.4435000    
 H    4.089000      0.9537000      0.2080000    
 H   -3.978700     -0.4388000      -1.433200    
 H   -4.204600      -1.212400      0.1590000    
 H   -2.043400      -1.757100     -0.7756000    
 H    2.251500      0.8629000       1.181800    
 H  -4.7699999E-02  -2.933200      -1.039500    
 H  -9.2100002E-02  0.9661000      0.8492000    
 H    1.915300      -3.877800      -1.199000    


%chk=000026410-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026410

0 1
O 4.590587 -1.643471 1.543718
O -2.492712 1.194260 0.822880
O 2.765977 -2.777744 -0.590782
N -5.107104 0.324566 0.508254
N 4.697352 0.454035 0.539411
N -1.675144 -0.809913 -0.098773
C -6.420926 0.528179 -0.136653
C -7.305770 1.407034 0.777158
C -7.122363 -0.823601 -0.421173
C 6.137905 0.650783 0.824517
C -8.714005 1.622104 0.174504
C -8.528170 -0.617313 -1.033360
C -9.409571 0.272489 -0.124961
C 6.479632 2.160762 0.800216
C 7.027675 -0.134741 -0.179807
C 6.428017 2.761679 -0.628095
C 6.961914 0.460849 -1.604975
C 7.326831 1.965765 -1.605980
C -4.071551 -0.300864 -0.313400
C 4.021313 -0.694133 0.923358
C -2.679995 0.105173 0.205077
C 2.547182 -0.686004 0.588504
C -0.276642 -0.715940 0.150640
C 1.931187 -1.767301 -0.099373
C 1.713962 0.368734 1.032294
C 0.537006 -1.781153 -0.318155
C 0.318311 0.376966 0.831294
H -6.309657 1.059515 -1.122359
H 6.309557 0.237534 1.836020
H -6.810259 2.384539 0.949068
H -7.387579 0.906846 1.763098
H -7.200284 -1.374307 0.537974
H -6.503251 -1.441570 -1.101972
H -9.330295 2.225813 0.868250
H -8.627551 2.205044 -0.765986
H -9.014453 -1.598117 -1.199259
H -8.431089 -0.137197 -2.029702
H -9.598731 -0.258727 0.830714
H -10.395338 0.446779 -0.598257
H 7.507617 2.279251 1.195903
H 5.804509 2.711340 1.483793
H 6.717147 -1.194729 -0.175454
H 8.073540 -0.098841 0.188684
H 6.740178 3.823169 -0.594041
H 5.384700 2.763549 -1.011905
H 7.640674 -0.097871 -2.277373
H 5.937613 0.329006 -2.010147
H 8.386771 2.083109 -1.297693
H 7.242210 2.383410 -2.627960
H -4.736976 1.176827 0.955992
H 4.209179 1.140887 -0.037992
H -4.122061 0.019990 -1.389127
H -4.167663 -1.407325 -0.312708
H -1.985855 -1.669112 -0.559403
H 2.169532 1.197487 1.586108
H 0.081771 -2.619551 -0.864792
H -0.306192 1.191832 1.198151
H 2.240435 -3.518381 -0.983765


