%chk=000073221.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073221

0 1
 O   -2.493600       3.076100     -0.4336000    
 O  -0.1019000      -2.800200      -1.709300    
 O   -4.809700     -0.8132000      0.3614000    
 N  -0.1550000      -1.070700      0.4055000    
 N  -0.1865000       1.705100     -0.1605000    
 N   -2.537700     -0.9452000      0.3845000    
 N   -3.685300       1.117400     -3.3199999E-02
 C    1.064900     -0.3742000      0.2600000    
 C    1.023200       1.006700     -2.1299999E-02
 C   -1.363500     -0.3977000      0.2704000    
 C    2.328200     -0.9833000      0.3806000    
 C    3.507500     -0.2496000      0.2283000    
 C    3.450500       1.109900     -4.8200000E-02
 C   -1.308500       1.075100     -2.9600000E-02
 C    2.213500       1.734400     -0.1723000    
 C  -0.1011000      -2.502300      0.6974000    
 C    4.819800     -0.9501000      0.3672000    
 C   -2.554500       1.883000     -0.1908000    
 C    4.695000       1.917100     -0.2173000    
 C  -8.6000003E-02  -3.289100     -0.5845000    
 C   -3.719200     -0.2492000      0.2452000    
 H    2.426100      -2.046700      0.5752000    
 H    2.159200       2.799700     -0.3893000    
 H   0.7265000      -2.803500       1.344600    
 H   -1.004500      -2.809900       1.238700    
 H    4.693300      -2.015400      0.5894000    
 H    5.393500     -0.8811000     -0.5628000    
 H    5.402500     -0.5179000       1.187200    
 H    4.471500       2.968100     -0.4315000    
 H    5.296300       1.895500      0.6974000    
 H    5.290600       1.537300      -1.053700    
 H   -4.580400       1.588900     -0.1276000    
 H  -6.6000000E-02  -4.385200     -0.4560000    


%chk=000073221-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000073221

0 1
O -2.709292 3.104732 -0.412702
O 0.343984 -2.888359 -1.713315
O -4.868678 -0.930136 0.455319
N -0.176817 -0.994772 0.394757
N -0.160564 1.795479 -0.161030
N -2.523308 -1.003112 0.416903
N -3.731985 1.051035 0.013960
C 1.051789 -0.332374 0.243409
C 1.025977 1.083188 -0.027582
C -1.398068 -0.306314 0.261904
C 2.303022 -0.985044 0.361807
C 3.511395 -0.275649 0.215342
C 3.494037 1.140787 -0.057081
C -1.306253 1.131586 -0.022732
C 2.255346 1.784640 -0.172597
C -0.249821 -2.442326 0.644136
C 4.831393 -1.008304 0.335786
C -2.604833 1.876120 -0.164464
C 4.787685 1.913415 -0.222072
C 0.092678 -3.310080 -0.565748
C -3.760874 -0.351529 0.308768
H 2.351054 -2.060977 0.551046
H 2.186447 2.856471 -0.382222
H 0.380886 -2.734033 1.505144
H -1.311230 -2.648273 0.907867
H 4.687291 -2.079784 0.550575
H 5.419359 -0.925272 -0.597994
H 5.457572 -0.578846 1.140776
H 4.590925 2.977908 -0.428561
H 5.416338 1.855561 0.686923
H 5.395717 1.514111 -1.056085
H -4.648526 1.504698 -0.069952
H 0.076054 -4.404749 -0.328786


