%chk=000130679.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130679

0 1
 O   -1.168600      -1.723600      0.4526000    
 O    1.245100       1.098000       1.365600    
 O   -5.757600     -0.8856000      -1.638800    
 O   -6.881700      0.7142000     -0.2302000    
 O    5.763800       1.710100     -0.7024000    
 O    7.041900     -0.7357000     -0.3691000    
 C  -0.5149000      0.5107000     -0.1040000    
 C   0.6307000     -0.4269000     -0.3742000    
 C   -1.454100     -0.3431000      0.7584000    
 C    1.534600     -0.2169000      0.8481000    
 C  -4.1000001E-02  -1.780700     -0.4321000    
 C   0.1453000       1.655000      0.6325000    
 C   -2.913300     -3.4800000E-02  0.5212000    
 C    3.003100     -0.3515000      0.5232000    
 C   -3.602100     -0.6782000     -0.5118000    
 C   -3.572100      0.8993000       1.342500    
 C    3.719900      0.7507000      5.4200001E-02
 C    3.646800      -1.578900      0.6903000    
 C   -4.933700     -0.3637000     -0.6896000    
 C   -4.921300       1.199600       1.141000    
 C    5.076200      0.6260000     -0.2466000    
 C   -5.575600      0.5500000      0.1147000    
 C    5.003000      -1.703700      0.3893000    
 C    5.717700     -0.6012000     -7.9099998E-02
 C   -6.990300     -0.1985000      -1.341400    
 C    5.797900       1.909500      -2.114100    
 H   -1.006700      0.8474000      -1.023700    
 H    1.154000     -0.1910000      -1.307800    
 H   -1.237100     -0.2270000       1.828000    
 H    1.286000     -0.9142000       1.658500    
 H  -0.4251000      -1.982100      -1.438100    
 H   0.6134000      -2.606900     -0.1405000    
 H   0.5586000       2.384700     -7.2200000E-02
 H  -0.5256000       2.179300       1.318500    
 H   -3.119000      -1.395300      -1.166500    
 H   -3.033700       1.399100       2.144100    
 H    3.233400       1.711900     -9.0800002E-02
 H    3.100900      -2.445800       1.053000    
 H   -5.430500       1.919200       1.771900    
 H    5.496900      -2.662500      0.5216000    
 H   -7.760200     -0.9436000      -1.109700    
 H   -7.301100      0.3645000      -2.229000    
 H    7.388500      0.1315000     -0.6412000    
 H    4.788800       2.090000      -2.498200    
 H    6.241900       1.045500      -2.618600    
 H    6.413200       2.789300      -2.321100    


%chk=000130679-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130679

0 1
O -1.216376 -1.837449 0.191319
O 1.394120 1.432465 0.728008
O -5.964818 -0.649291 -1.699262
O -7.002607 0.790012 -0.076618
O 6.165771 1.072290 -1.287868
O 7.197175 -1.156935 -0.230280
C -0.537537 0.406324 -0.351426
C 0.707750 -0.510923 -0.507830
C -1.459313 -0.430693 0.590506
C 1.630711 -0.030632 0.656389
C 0.161476 -1.946984 -0.359716
C 0.009062 1.712637 0.264343
C -2.939670 -0.120030 0.479666
C 3.109892 -0.298830 0.461740
C -3.685537 -0.632854 -0.622544
C -3.560713 0.714553 1.439866
C 3.895211 0.582330 -0.326847
C 3.705904 -1.452809 1.020239
C -5.027011 -0.266204 -0.705890
C -4.930543 1.086026 1.337068
C 5.251146 0.291227 -0.547269
C -5.638603 0.578232 0.246924
C 5.068997 -1.751533 0.786385
C 5.845180 -0.883495 0.000756
C -7.253447 -0.027675 -1.294805
C 5.672307 2.322453 -1.867100
H -1.057811 0.580138 -1.308534
H 1.228380 -0.358866 -1.468470
H -1.130947 -0.284227 1.643313
H 1.293329 -0.505864 1.604383
H 0.082153 -2.470453 -1.328827
H 0.778575 -2.560123 0.325828
H 0.073564 2.532754 -0.472541
H -0.600606 2.055221 1.123744
H -3.220300 -1.312637 -1.339963
H -2.978528 1.077754 2.294540
H 3.429580 1.493948 -0.712073
H 3.111292 -2.122913 1.652232
H -5.410575 1.728207 2.079407
H 5.542926 -2.640152 1.213006
H -7.976439 -0.825436 -1.048472
H -7.602639 0.634506 -2.104933
H 7.571688 -0.423248 -0.787140
H 5.305107 3.005100 -1.077455
H 4.862942 2.126965 -2.596363
H 6.536083 2.771214 -2.379036


