%chk=000147024.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147024

0 1
 O    3.786100      -1.912600      0.8567000    
 O   -2.242200      -2.108300     -0.2917000    
 O   -4.007200     -0.1179000      0.5122000    
 N    2.258300     -0.1332000      0.7725000    
 N    4.305800      0.1547000     -0.1247000    
 C    2.216200       1.185400      0.1780000    
 C    1.261800       1.213100      -1.008000    
 C    3.664800       1.441300     -0.2404000    
 C  -0.1434000      0.8548000     -0.6029000    
 C    3.486100     -0.7701000      0.5384000    
 C  -0.5458000     -0.4729000     -0.6354000    
 C   -1.015900       1.857300     -0.2035000    
 C   -1.847900     -0.8049000     -0.2606000    
 C   -2.317700       1.525400      0.1712000    
 C   -2.733700      0.1943000      0.1428000    
 C   -1.276100      -3.068000     -0.7160000    
 C   -4.849400      0.9616000      0.9114000    
 H    1.899200       1.898200      0.9477000    
 H    1.596500      0.5230000      -1.794800    
 H    1.268200       2.209200      -1.469800    
 H    3.780100       1.822000      -1.258900    
 H    4.166500       2.121000      0.4559000    
 H    1.491100     -0.5633000       1.279500    
 H    5.263100     -3.6100000E-02 -0.4030000    
 H   0.1836000      -1.205100     -0.9636000    
 H  -0.6997000       2.896400     -0.1764000    
 H   -2.950100       2.352900      0.4737000    
 H  -0.4205000      -3.108900     -3.3300001E-02
 H  -0.9735000      -2.903700      -1.755800    
 H   -1.759400      -4.049900     -0.6778000    
 H   -4.471000       1.457000       1.812100    
 H   -5.822800      0.5322000       1.170200    
 H   -5.020900       1.665100      8.9400001E-02


%chk=000147024-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000147024

0 1
O 3.671055 -2.027368 0.725892
O -2.302110 -2.077309 -0.241781
O -4.014059 -0.197152 0.502137
N 2.358033 -0.037015 0.880707
N 4.287616 0.062442 -0.250008
C 2.314158 1.278652 0.216926
C 1.350488 1.307901 -1.013910
C 3.815303 1.455141 -0.200617
C -0.082056 0.954282 -0.648796
C 3.462759 -0.807238 0.482517
C -0.504152 -0.404930 -0.650172
C -1.005189 1.945489 -0.254212
C -1.812522 -0.768498 -0.264230
C -2.321771 1.597549 0.135510
C -2.738585 0.249174 0.138316
C -1.382022 -3.144993 -0.647518
C -4.982486 0.820301 0.915846
H 2.007984 2.065882 0.929316
H 1.748761 0.605111 -1.771130
H 1.396065 2.325606 -1.448599
H 3.900213 1.959364 -1.180037
H 4.365452 2.052281 0.555291
H 1.524921 -0.487804 1.255602
H 5.231480 -0.216738 -0.505514
H 0.201170 -1.176327 -0.976829
H -0.706771 3.000568 -0.254898
H -3.018452 2.387537 0.431456
H -0.493981 -3.187502 0.012717
H -1.057435 -3.018315 -1.698671
H -1.964080 -4.072490 -0.547351
H -4.633580 1.368996 1.812796
H -5.897066 0.258900 1.156351
H -5.188938 1.538504 0.097990


