%chk=000111087.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111087

0 1
 O   0.7846000       1.284900     -0.5339000    
 O    3.538700      -1.691800      9.4599999E-02
 O  -0.9458000     -0.2582000     -0.7497000    
 O    4.194400       1.024100      0.8013000    
 O    1.269400       3.966900     -0.2084000    
 O  -0.4260000      -3.113900      -1.381700    
 N   0.6973000      -2.273100      0.4755000    
 C    1.226500      -1.074000     -0.1407000    
 C    2.576600     -0.7096000      0.4841000    
 C    3.058400      0.6662000      1.8700000E-02
 C    1.949100       1.709100      0.1770000    
 C   0.2269000      8.0499999E-02 -1.0600000E-02
 C    2.350400       3.069300     -0.3847000    
 C  -8.5000001E-02  -3.189400     -0.2042000    
 C   -2.125400      0.2721000     -0.3037000    
 C  -0.4791000      -4.354300      0.6636000    
 C   -2.282000       1.653400     -0.2423000    
 C   -3.159100     -0.5739000      8.5699998E-02
 C   -3.484400       2.194000      0.2132000    
 C   -4.361600     -3.3000000E-02  0.5410000    
 C   -4.524100       1.350900      0.6049000    
 H    1.373300      -1.295800      -1.206800    
 H    2.524400     -0.7380000       1.579600    
 H    3.380900      0.5999000      -1.028300    
 H    1.685900       1.843500       1.235100    
 H  -3.1800002E-02  0.2295000       1.048600    
 H    2.569100       3.013200      -1.456300    
 H    3.220500       3.482700      0.1321000    
 H   0.8665000      -2.414500       1.467600    
 H    3.607400      -1.679700     -0.8753000    
 H    4.609400       1.798300      0.3856000    
 H   0.5073000       3.607000     -0.6931000    
 H   0.4128000      -4.918100      0.9510000    
 H  -0.9898000      -3.995000       1.561600    
 H   -1.156500      -5.012600      0.1128000    
 H   -1.496200       2.329800     -0.5604000    
 H   -3.036900      -1.652400      3.8400002E-02
 H   -3.612900       3.271600      0.2585000    
 H   -5.171200     -0.6896000      0.8459000    
 H   -5.460800       1.771900      0.9584000    


%chk=000111087-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111087

0 1
O 0.550002 1.320252 -0.594388
O 3.578292 -1.554108 -0.319271
O -1.175670 -0.286215 -0.527348
O 4.165183 1.102727 0.250454
O 1.019514 4.067361 -0.283608
O 2.385089 -3.684815 0.537196
N 0.502414 -2.332200 0.163959
C 1.093615 -1.082031 -0.378875
C 2.504652 -0.701612 0.156617
C 2.899363 0.704389 -0.354621
C 1.848283 1.763222 -0.001514
C 0.119400 0.063951 0.000854
C 2.113708 3.145565 -0.599118
C 1.118386 -3.506230 0.528354
C -2.311053 0.456851 -0.091738
C 0.188365 -4.639057 0.941996
C -2.235550 1.616587 0.713584
C -3.554536 -0.049635 -0.529659
C -3.436910 2.256841 1.097074
C -4.742299 0.606037 -0.143609
C -4.690126 1.759417 0.675466
H 1.142863 -1.136528 -1.485440
H 2.469515 -0.683810 1.270993
H 2.996082 0.634782 -1.460478
H 1.735962 1.846113 1.101107
H 0.066306 0.175964 1.111140
H 2.260558 3.053450 -1.695898
H 3.021074 3.573084 -0.147532
H -0.522185 -2.333184 0.117983
H 3.359168 -2.499019 -0.002807
H 4.769935 0.318440 0.152578
H 0.186911 3.671863 -0.651608
H 0.502523 -5.015503 1.929730
H -0.873548 -4.345196 0.989503
H 0.298065 -5.472486 0.226479
H -1.272164 2.036703 1.014530
H -3.574520 -0.939624 -1.166381
H -3.384519 3.156803 1.719478
H -5.707655 0.215780 -0.483678
H -5.613290 2.266968 0.973195


