%chk=000115108.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115108

0 1
 O    3.790000      -2.217400     -0.4883000    
 O    3.853400     -0.3617000      0.8192000    
 O   0.1743000       3.887700      0.6722000    
 N  -0.6202000       2.070500     -4.1600000E-02
 N   0.2197000       3.064300     -0.2496000    
 N   -2.575000      -2.084200     -0.8750000    
 C  -0.1393000      0.7685000     -0.5145000    
 C    1.286600      0.4947000      7.0000002E-03
 C   -1.096900     -0.3522000     -0.1473000    
 C    1.879200     -0.8105000     -0.5340000    
 C   -1.344000     -0.6359000       1.174600    
 C   -1.942300       2.344100     -0.6157000    
 C   -1.712200      -1.076000      -1.133500    
 C    3.262700      -1.071700      1.7300000E-02
 C   -2.225900      -1.666500       1.480500    
 C   -2.810100      -2.353800      0.4288000    
 H  -6.0100000E-02  0.8041000      -1.613100    
 H    1.974000       1.298800     -0.2867000    
 H    1.301000      0.4720000       1.105300    
 H    1.258200      -1.667200     -0.2537000    
 H    1.949600     -0.7600000      -1.626100    
 H  -0.8774000     -7.8900002E-02   1.980800    
 H   -1.935400       2.321400      -1.713100    
 H   -2.303800       3.336200     -0.3119000    
 H   -2.707200       1.648200     -0.2552000    
 H   -1.544200     -0.8830000      -2.187500    
 H   -2.450100      -1.922700       2.509600    
 H   -3.505500      -3.165900      0.6141000    
 H    4.687300      -2.394300     -0.1334000    


%chk=000115108-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000115108

0 1
O 3.944220 -2.099090 -0.869076
O 3.833851 -0.590840 0.893450
O -0.705240 3.697513 1.305485
N -0.651524 2.031553 -0.216693
N -0.185632 2.568780 0.976927
N -2.485737 -2.368247 -0.627557
C -0.138578 0.683194 -0.577233
C 1.309400 0.463894 -0.058184
C -1.101844 -0.408322 -0.095821
C 1.931240 -0.797764 -0.684634
C -1.466330 -0.511231 1.270914
C -1.717015 2.658859 -1.018645
C -1.641469 -1.358849 -0.996263
C 3.302393 -1.105445 -0.113309
C -2.335394 -1.547019 1.671714
C -2.818838 -2.449747 0.693633
H -0.114057 0.656220 -1.686297
H 1.916912 1.351471 -0.310001
H 1.319718 0.386191 1.040591
H 1.294387 -1.687276 -0.506703
H 2.027369 -0.710277 -1.783557
H -1.081312 0.213069 1.998406
H -1.330793 2.964916 -2.007934
H -2.062039 3.550878 -0.469828
H -2.556933 1.954965 -1.157776
H -1.393167 -1.316312 -2.065443
H -2.639126 -1.656814 2.717357
H -3.497970 -3.265373 0.966154
H 4.829906 -2.300297 -0.460477


