%chk=000159110.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159110

0 1
 O   -1.314500       2.792900      0.2052000    
 O    2.569300      -2.900900     -0.3973000    
 N   -2.586600      0.8410000      0.1840000    
 N  -0.2615000      0.7343000     -4.4999998E-03
 N    1.025700      -1.183500      4.4100001E-02
 N   -1.404800      -1.353100     -5.5000000E-03
 C   -2.659900     -0.5988000     -0.1982000    
 C  -0.3210000     -0.6711000      1.1600000E-02
 C    1.091000       1.115800     -2.3700001E-02
 C   -1.374700       1.566200      0.1099000    
 C    1.878700     -4.2199999E-02  6.3999998E-03
 C   -3.003700     -0.7144000      -1.695300    
 C   -3.716500      -1.358500      0.6230000    
 C   -3.828500       1.571200      0.4333000    
 C    1.655900       2.379700     -5.2600000E-02
 C    3.261800      4.5000002E-02  6.8000001E-03
 C    1.502700      -2.508500      7.7399999E-02
 C    3.048900       2.471900     -5.4900002E-02
 C    3.843800       1.316100     -2.5300000E-02
 C   0.5940000      -3.502900      0.7555000    
 H   -3.031400      -1.762100      -2.016500    
 H   -2.255900     -0.2029000      -2.312500    
 H   -3.977900     -0.2685000      -1.922000    
 H   -3.515400      -1.264700       1.696500    
 H   -3.711100      -2.428400      0.3824000    
 H   -4.729600     -0.9875000      0.4350000    
 H   -4.490200       1.468400     -0.4304000    
 H   -3.643100       2.634800      0.6037000    
 H   -4.311000       1.165000       1.326000    
 H    1.063000       3.285500     -7.8400001E-02
 H    3.898500     -0.8311000      3.9700001E-02
 H    3.524300       3.448800     -7.9000004E-02
 H    4.926600       1.411300     -2.4499999E-02
 H   9.7599998E-02  -3.050700       1.618100    
 H    1.185400      -4.351300       1.112300    
 H  -0.1513000      -3.862800      4.1800000E-02


%chk=000159110-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000159110

0 1
O -1.306943 2.803355 0.168495
O 2.736836 -2.727134 0.351884
N -2.572335 0.814426 0.204892
N -0.230758 0.732736 -0.041314
N 1.051278 -1.142646 0.176203
N -1.391388 -1.385266 0.129872
C -2.666570 -0.667453 -0.132640
C -0.300888 -0.678460 0.092137
C 1.124607 1.162069 -0.049031
C -1.394716 1.543729 0.100843
C 1.930960 -0.003209 0.075664
C -2.996759 -0.821362 -1.644130
C -3.747962 -1.336764 0.741670
C -3.816643 1.577832 0.417710
C 1.681050 2.445833 -0.155755
C 3.334118 0.087008 0.086012
C 1.498700 -2.492900 0.318864
C 3.094898 2.537008 -0.143420
C 3.902888 1.381166 -0.026977
C 0.456544 -3.584398 0.427403
H -3.062445 -1.892001 -1.902147
H -2.206449 -0.358995 -2.261482
H -3.961539 -0.341662 -1.887530
H -3.535897 -1.175054 1.812293
H -3.720062 -2.421022 0.545650
H -4.759017 -0.963402 0.507914
H -4.529369 1.421285 -0.413064
H -3.554295 2.645900 0.462316
H -4.301056 1.286674 1.365626
H 1.036685 3.322882 -0.231366
H 3.947780 -0.808136 0.180178
H 3.565920 3.522396 -0.223766
H 4.993342 1.481168 -0.020935
H -0.227043 -3.406521 1.274585
H 0.991295 -4.537544 0.553944
H -0.186166 -3.617539 -0.468498


