%chk=000155935.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155935

0 1
 O    2.761500      -1.752000     -0.2816000    
 O   -1.819400      -3.015100     -0.1187000    
 O   0.7961000       2.949300      1.4700000E-02
 O   -2.523200       2.034400      0.1310000    
 N    2.052600      0.9602000     -0.1324000    
 N   -2.590700     -0.3200000      3.6100000E-02
 C    1.082500     -4.4700000E-02 -0.1276000    
 C   -1.245200     -0.6863000     -4.3800000E-02
 C    1.450100      -1.388100     -0.2032000    
 C  -0.2652000      0.3062000     -4.7699999E-02
 C  -0.8775000      -2.029800     -0.1195000    
 C   0.4702000      -2.380600     -0.1991000    
 C    1.861100       2.345700     -6.5200001E-02
 C   -3.131300      0.9691000      0.1174000    
 C    3.171300       3.092100     -9.7300000E-02
 C    3.444700      -1.979500      0.9490000    
 C   -4.637500      0.9390000      0.1879000    
 H  -0.5468000       1.335000      1.0700000E-02
 H   0.7638000      -3.425800     -0.2595000    
 H    3.014200      0.6332000     -0.1979000    
 H   -3.249800      -1.095900      3.4299999E-02
 H   -1.376300      -3.879000     -0.1772000    
 H    3.783400       2.801900      0.7613000    
 H    2.985700       4.168900     -5.3700000E-02
 H    3.706600       2.861700      -1.022700    
 H    2.999600      -2.826100       1.481200    
 H    3.420600      -1.085800       1.580400    
 H    4.487300      -2.218700      0.7226000    
 H   -5.040800      0.4849000     -0.7216000    
 H   -5.024800       1.957700      0.2787000    
 H   -4.956900      0.3596000       1.058700    


%chk=000155935-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000155935

0 1
O 2.921650 -1.284290 0.313694
O -1.818143 -2.808191 0.392867
O 0.933655 3.205802 -0.244305
O -2.824337 2.012308 -0.176142
N 2.137962 1.207159 0.012445
N -2.644678 -0.312476 0.092301
C 1.097238 0.245697 0.102085
C -1.237628 -0.493804 0.140929
C 1.520786 -1.107787 0.265009
C -0.283471 0.549945 0.040973
C -0.793037 -1.832954 0.301930
C 0.577859 -2.149857 0.364875
C 2.034147 2.588139 -0.150178
C -3.362930 0.873443 -0.056873
C 3.376362 3.318827 -0.207117
C 3.433002 -2.642106 0.488305
C -4.881487 0.694573 -0.065200
H -0.611752 1.582784 -0.082466
H 0.896785 -3.190207 0.488912
H 3.076113 0.802893 0.078098
H -3.175356 -1.183326 0.181375
H -1.447739 -3.715598 0.505533
H 3.410562 4.066759 0.603884
H 3.442978 3.869355 -1.161427
H 4.253098 2.653919 -0.116663
H 3.130409 -3.293726 -0.354406
H 3.085185 -3.079061 1.444574
H 4.528310 -2.543294 0.503883
H -5.283618 1.102161 -1.008781
H -5.315611 1.288526 0.757668
H -5.210411 -0.354114 0.039517


