%chk=000129623.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129623

0 1
 O    3.902400      0.3598000      0.2082000    
 O   -1.347600       1.715200      -1.453000    
 N   -1.518000     -0.2605000     -0.2417000    
 N    3.046100       1.366000      0.8199000    
 N    2.466700       2.181100     -0.1304000    
 N   0.4185000      0.9247000     -0.1866000    
 C    5.440900      -1.421800      0.6464000    
 C    6.526000     -0.8023000     -0.2297000    
 C   -2.899800     -0.4454000     -5.5000000E-03
 C   -3.678800      0.6389000      0.3725000    
 C   -3.455200      -1.708000     -0.1563000    
 C    4.536700     -0.3602000       1.256300    
 C    7.452900      -1.862800     -0.8021000    
 C   -5.042200      0.4565000      0.6045000    
 C   -4.818600      -1.890300      7.5700000E-02
 C   -5.612000     -0.8082000      0.4562000    
 C   -3.097700       2.005600      0.5398000    
 C   -2.631600      -2.886800     -0.5634000    
 C  -0.8636000      0.8754000     -0.6990000    
 C    1.174900       1.923100     -0.5117000    
 H    4.837800      -2.103700      3.4499999E-02
 H    5.897400      -2.012400       1.448900    
 H    6.076400     -0.2436000      -1.058500    
 H    7.117500     -9.0099998E-02  0.3577000    
 H    5.129800      0.3192000       1.880900    
 H    3.778000     -0.8452000       1.882300    
 H    8.223100      -1.397100      -1.424800    
 H    6.898900      -2.574600      -1.422500    
 H    7.953200      -2.419500     -3.1999999E-03
 H   -5.675000       1.289700      0.8987000    
 H   -5.279000      -2.868600     -3.4600001E-02
 H   -6.673600     -0.9499000      0.6363000    
 H   -2.117400       2.016600       1.022300    
 H   -3.725400       2.572300       1.242300    
 H   -3.130700       2.578700     -0.3894000    
 H   -1.915300      -3.142500      0.2243000    
 H   -2.092000      -2.680100      -1.493700    
 H   -3.251100      -3.772200     -0.7441000    
 H  -0.9228000      -1.060300     -4.3000001E-02
 H    3.733600       1.935700       1.313900    
 H    3.005200       2.950500     -0.5145000    
 H   0.8216000       2.712500      -1.198200    


%chk=000129623-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000129623

0 1
O 4.306436 0.968605 0.160093
O -1.254123 1.916058 -1.213688
N -1.307751 0.262587 0.473002
N 3.400630 1.966005 0.867680
N 2.655783 2.687339 -0.096364
N 0.659435 1.412841 0.183875
C 4.682349 -1.365139 -0.362155
C 6.136403 -1.408861 0.162068
C -2.629096 -0.269066 0.313270
C -3.775244 0.579222 0.343093
C -2.754474 -1.685653 0.178618
C 3.770547 -0.399694 0.403595
C 7.017721 -2.399582 -0.627832
C -5.049701 -0.022802 0.188436
C -4.046431 -2.243816 0.046674
C -5.191827 -1.417804 0.038890
C -3.663985 2.071924 0.571681
C -1.522882 -2.574733 0.161755
C -0.704495 1.264609 -0.274811
C 1.345860 2.362678 -0.400407
H 4.678232 -1.089955 -1.435561
H 4.233066 -2.377522 -0.293182
H 6.569157 -0.392186 0.109067
H 6.126622 -1.691357 1.234790
H 3.783885 -0.600287 1.493124
H 2.724599 -0.441349 0.047102
H 8.052764 -2.417148 -0.240056
H 7.063153 -2.122420 -1.698089
H 6.615755 -3.428942 -0.565486
H -5.938991 0.618150 0.204090
H -4.150748 -3.329585 -0.063706
H -6.187875 -1.860120 -0.073689
H -2.951854 2.299846 1.386867
H -4.645208 2.501949 0.835720
H -3.278715 2.578175 -0.331930
H -1.011156 -2.600756 1.145410
H -0.781844 -2.223714 -0.580347
H -1.795047 -3.613614 -0.089191
H -0.657613 -0.211054 1.106477
H 4.100785 2.618707 1.266561
H 3.149670 3.293658 -0.763352
H 0.916408 3.000207 -1.196390


