%chk=000075879.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075879

0 1
 O    1.629800       1.269900      0.6134000    
 O   -1.631400       1.270700     -0.6136000    
 O    3.379900      -2.484500      0.5183000    
 O   -3.379500      -2.484600     -0.5188000    
 N    3.495400     -0.1346000      0.5387000    
 N   -3.496200     -0.1348000     -0.5388000    
 C    5.912600       1.469800     -0.8153000    
 C   -5.914000       1.467900      0.8159000    
 C    5.792300      1.2400000E-02 -0.3783000    
 C   -5.793100      1.0700000E-02  0.3787000    
 C    4.577400       2.157600      -1.086500    
 C   -4.579200       2.156500       1.086900    
 C    4.927300     -0.1775000      0.8646000    
 C   -4.928200     -0.1786000     -0.8644000    
 C    3.717000       2.316700      0.1633000    
 C   -3.719200       2.316200     -0.1630000    
 C    2.840700       1.107300      0.4403000    
 C   -2.842300       1.107400     -0.4403000    
 C    2.835300      -1.384000      0.4364000    
 C   -2.835500      -1.383800     -0.4369000    
 C    1.375800      -1.383800      0.2115000    
 C   -1.375900      -1.383000     -0.2123000    
 C   0.8760000      -1.383300      -1.087700    
 C  -0.5027000      -1.382800      -1.300000    
 C   0.5082000      -1.384000       1.300200    
 C  -0.8704000      -1.383600       1.087800    
 H    6.520100       1.508900      -1.727600    
 H    6.464700       2.033900     -5.3100001E-02
 H   -6.521500       1.506500       1.728500    
 H   -6.466700       2.031900      5.4000001E-02
 H    5.404900     -0.5925000      -1.207300    
 H    6.802500     -0.3561000     -0.1619000    
 H   -5.405200     -0.5941000       1.207600    
 H   -6.803200     -0.3584000      0.1625000    
 H    4.030200       1.617400      -1.868600    
 H    4.794300       3.157000      -1.483600    
 H   -4.031700       1.616500       1.868800    
 H   -4.796600       3.155700       1.484100    
 H    5.168100      -1.147100       1.314700    
 H    5.154100      0.5805000       1.622300    
 H   -5.168500      -1.148300      -1.314500    
 H   -5.155600      0.5794000      -1.621900    
 H    3.036100       3.161700     -2.9000000E-03
 H    4.308300       2.566100       1.050100    
 H   -3.038800       3.161700      3.0000000E-03
 H   -4.310800       2.565400      -1.049600    
 H    1.548600      -1.382200      -1.941300    
 H  -0.8862000      -1.382200      -2.317000    
 H   0.8924000      -1.384100       2.316600    
 H   -1.542400      -1.382800       1.942100    


%chk=000075879-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000075879

0 1
O 2.651192 2.401517 0.175414
O -2.650559 2.397713 -0.173594
O 2.684728 -0.937115 2.364005
O -2.684071 -0.940894 -2.362692
N 3.750889 0.413841 0.773472
N -3.750645 0.410702 -0.772832
C 6.435817 0.069475 -1.074373
C -6.436686 0.066311 1.073499
C 5.742995 -0.900485 -0.091485
C -5.743711 -0.903338 0.090414
C 5.517267 1.170616 -1.650799
C -5.518066 1.166841 1.650997
C 5.066353 -0.208810 1.113198
C -5.066271 -0.211154 -1.113517
C 4.952172 2.157426 -0.590015
C -4.951893 2.153949 0.591074
C 3.690395 1.689613 0.136928
C -3.689845 1.685944 -0.135268
C 2.580727 -0.202538 1.339349
C -2.580434 -0.205649 -1.338449
C 1.269365 -0.056294 0.630861
C -1.269096 -0.057919 -0.630288
C 1.174989 -0.059527 -0.784721
C -0.083865 -0.082405 -1.407879
C 0.084131 -0.080295 1.408464
C -1.174752 -0.058933 0.785278
H 6.872793 -0.512885 -1.908994
H 7.286534 0.559176 -0.555159
H -6.874289 -0.516342 1.907590
H -7.286973 0.556586 0.554126
H 4.984429 -1.510827 -0.620001
H 6.497282 -1.608618 0.304887
H -4.985630 -1.514286 0.618925
H -6.498067 -1.610941 -0.306769
H 4.680223 0.714421 -2.216625
H 6.098909 1.763308 -2.382574
H -4.681552 0.710042 2.217121
H -6.099921 1.759421 2.382696
H 4.848358 -0.941750 1.906970
H 5.736546 0.554911 1.549574
H -4.848326 -0.943602 -1.907755
H -5.735950 0.553210 -1.549547
H 4.664845 3.110037 -1.065755
H 5.745609 2.394665 0.148310
H -4.664463 3.106201 1.067474
H -5.744771 2.391932 -0.147624
H 2.084579 -0.068067 -1.394288
H -0.169266 -0.123504 -2.498031
H 0.169548 -0.119756 2.498676
H -2.084371 -0.066924 1.394828


