%chk=000043657.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043657

0 1
 O    2.319400     -5.4900002E-02 -0.5825000    
 O    2.764500       1.321400       1.214100    
 C  -0.6022000       1.966300      5.1100001E-02
 C   -2.067200       1.767400     -0.3430000    
 C   0.3064000       1.987400      -1.182000    
 C   -2.978700       1.774500      0.8839000    
 C    1.774700       2.212900     -0.8214000    
 C   -4.431600       1.544400      0.4997000    
 C    2.338100       1.138400      8.2099997E-02
 C    2.853500      -1.170400      0.1380000    
 C    1.742100      -1.847300      0.9312000    
 C   0.6626000      -2.380400      3.1800002E-02
 C  -0.6185000      -1.987400      8.9000002E-02
 C   -1.696900      -2.526400     -0.8033000    
 C   -2.366100      -3.746000     -0.1888000    
 H  -0.2985000       1.165200      0.7337000    
 H  -0.4952000       2.911500      0.5973000    
 H   -2.177400      0.8183000     -0.8803000    
 H   -2.374700       2.564300      -1.031100    
 H   0.1979000       1.043100      -1.729200    
 H  -1.4900000E-02   2.787300      -1.859800    
 H   -2.891200       2.733400       1.407700    
 H   -2.665500      0.9918000       1.584600    
 H    2.391200       2.258900      -1.726300    
 H    1.889800       3.176500     -0.3113000    
 H   -5.065700       1.554200       1.391700    
 H   -4.786800       2.326900     -0.1785000    
 H   -4.557300      0.5764000      4.1000000E-03
 H    3.275700      -1.860900     -0.6010000    
 H    3.678800     -0.8690000      0.7939000    
 H    1.318000      -1.139000       1.652800    
 H    2.162100      -2.681900       1.503800    
 H   0.9570000      -3.130300     -0.6983000    
 H  -0.9221000      -1.253700      0.8309000    
 H   -1.283100      -2.793400      -1.783000    
 H   -2.440300      -1.741500     -0.9815000    
 H   -1.649900      -4.561100     -3.9799999E-02
 H   -3.160700      -4.111800     -0.8470000    
 H   -2.815100      -3.504600      0.7807000    


%chk=000043657-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043657

0 1
O 2.497680 0.069754 -0.687907
O 2.810942 1.215417 1.320732
C -0.606153 1.970718 0.059937
C -2.048817 1.692169 -0.417142
C 0.389817 2.131770 -1.109450
C -3.045357 1.478144 0.744972
C 1.852041 2.381859 -0.646893
C -4.479092 1.167823 0.263459
C 2.431195 1.208402 0.125898
C 3.012671 -1.175837 -0.050082
C 1.919666 -1.906763 0.755760
C 0.748180 -2.380236 -0.079326
C -0.550698 -2.057474 0.150582
C -1.733608 -2.538040 -0.665064
C -2.792753 -3.272078 0.196826
H -0.276718 1.137469 0.713488
H -0.591627 2.883946 0.690573
H -2.047794 0.792265 -1.067706
H -2.400079 2.533262 -1.051435
H 0.369138 1.226039 -1.744563
H 0.076854 2.983753 -1.745551
H -3.055871 2.381612 1.388302
H -2.682629 0.647505 1.385737
H 2.487871 2.560766 -1.534445
H 1.908127 3.268566 0.007692
H -5.170770 1.025849 1.114215
H -4.875320 1.991174 -0.360551
H -4.500706 0.244860 -0.347340
H 3.360032 -1.778004 -0.906010
H 3.861957 -0.911966 0.605662
H 1.576560 -1.253011 1.577689
H 2.418523 -2.780322 1.229141
H 0.990842 -3.037995 -0.930322
H -0.790840 -1.399461 1.002959
H -1.382507 -3.202173 -1.478208
H -2.220379 -1.667346 -1.153589
H -2.360759 -4.172144 0.670086
H -3.657270 -3.584788 -0.417247
H -3.170147 -2.614984 1.003121


