%chk=000131215.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131215

0 1
 O   -4.977600     -0.7201000      0.4958000    
 N   7.7600002E-02   1.261600     -0.2624000    
 N    3.025100     -0.1837000     -0.1401000    
 C   0.7133000      0.1826000     -0.8154000    
 C   -1.236900      0.9523000      5.7999999E-03
 C   -1.437200     -0.3709000     -0.3931000    
 C    2.137300      0.2208000      -1.207700    
 C  -0.1984000     -0.8437000     -0.9093000    
 C   0.6969000       2.543700      2.7000001E-03
 C   -2.253500       1.734700      0.5650000    
 C   -2.713800     -0.9435000     -0.2265000    
 C   -3.740200     -0.1730000      0.3319000    
 C   -3.511400       1.145300      0.7208000    
 C    4.429900     -7.4699998E-02 -0.5525000    
 C    2.738400      -1.557300      0.2920000    
 C    5.328800     -0.4125000      0.5554000    
 C   -5.147900      -2.073000      7.8299999E-02
 C    6.069400     -0.6885000       1.459200    
 H    2.274400     -0.4248000      -2.087400    
 H    2.397900       1.228800      -1.555000    
 H  -5.0000002E-04  -1.829500      -1.308600    
 H   9.5799997E-02   3.121800      0.7062000    
 H    1.681200       2.382200      0.4492000    
 H   0.7843000       3.081200     -0.9448000    
 H   -2.093400       2.763200      0.8686000    
 H   -2.832100      -1.971500     -0.5471000    
 H   -4.319700       1.731500       1.152000    
 H    4.640300     -0.7222000      -1.413200    
 H    4.641600      0.9555000     -0.8643000    
 H    1.746500      -1.640200      0.7466000    
 H    3.410200      -1.897900       1.086900    
 H    2.807700      -2.274300     -0.5350000    
 H   -6.188900      -2.344800      0.2814000    
 H   -4.521000      -2.756800      0.6607000    
 H   -4.994700      -2.184600      -1.000500    
 H    6.725800     -0.9335000       2.261100    


%chk=000131215-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131215

0 1
O -5.194157 -0.521217 0.406924
N 0.180762 0.956119 -0.089796
N 3.104219 -0.185864 -0.207908
C 0.687749 -0.105325 -0.865229
C -1.188407 0.734495 0.126606
C -1.549550 -0.497950 -0.521688
C 2.116806 -0.161433 -1.329603
C -0.347451 -1.007398 -1.138177
C 0.925464 2.128558 0.380089
C -2.137176 1.508033 0.834620
C -2.891991 -0.964596 -0.453074
C -3.829990 -0.187600 0.255904
C -3.458483 1.036459 0.893819
C 4.489998 -0.058913 -0.736879
C 2.940963 -1.361217 0.677972
C 5.500962 0.141937 0.317962
C -5.650027 -1.756724 -0.224887
C 6.374792 0.305255 1.171711
H 2.217068 -1.056055 -1.993160
H 2.356168 0.727297 -1.950129
H -0.241666 -1.925564 -1.714454
H 0.625754 2.373393 1.414646
H 2.000071 1.884322 0.383198
H 0.736246 3.012912 -0.258724
H -1.866426 2.450695 1.321522
H -3.173322 -1.901564 -0.942405
H -4.236270 1.592861 1.425303
H 4.786868 -0.954972 -1.342968
H 4.513969 0.810109 -1.424054
H 1.912701 -1.380103 1.074021
H 3.645552 -1.280754 1.522121
H 3.129090 -2.329003 0.149597
H -6.723212 -1.824132 0.008322
H -5.123178 -2.640982 0.186679
H -5.508703 -1.725873 -1.323947
H 7.130004 0.448994 1.922767


