%chk=000010829.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010829

0 1
 O   0.1184000     -3.2699998E-02  0.6176000    
 O    6.365200     -0.1989000      0.4322000    
 O    2.372400       2.274400     -0.3620000    
 O   -3.893500       2.467300      2.9100001E-02
 O   0.3715000     -0.1028000      -1.698200    
 O   -6.112400      0.1709000       1.100300    
 O   -6.026800      0.1001000      -1.170000    
 C    2.308200     -0.1241000     -0.3072000    
 C    2.941000      -1.343500     -0.1587000    
 C   -3.341700      -1.153800      0.2228000    
 C   -1.231700      1.1000000E-03  0.4476000    
 C   -3.998500      7.0400000E-02  9.8499998E-02
 C    2.995800       1.071300     -0.2150000    
 C   -1.958400      -1.188500      0.3973000    
 C    4.312900      -1.368900      9.1499999E-02
 C    5.026400     -0.1742000      0.1884000    
 C   -3.271900       1.260200      0.1490000    
 C   0.8473000     -9.0099998E-02 -0.5728000    
 C   -1.888400       1.225500      0.3234000    
 C    4.367900       1.045900      3.5200000E-02
 C    2.202900      -2.638700     -0.2576000    
 C   -4.093800      -2.443700      0.1725000    
 C   -5.445600      0.1136000     -8.3099999E-02
 C    7.032700       1.059100      0.5190000    
 H   -1.436300      -2.137200      0.4957000    
 H    4.836800      -2.313900      0.2128000    
 H   -1.321700       2.152500      0.3628000    
 H    4.867300       2.007100      9.9399999E-02
 H    1.442100      -2.706900      0.5268000    
 H    1.723000      -2.733900      -1.237200    
 H    2.870700      -3.499000     -0.1394000    
 H   -4.815100      -2.499900      0.9943000    
 H   -4.622000      -2.543700     -0.7815000    
 H   -3.427200      -3.308200      0.2652000    
 H    1.423900       2.149000     -0.5256000    
 H   -4.850100       2.349600     -8.5900001E-02
 H    8.089300      0.8510000      0.7168000    
 H    6.661700       1.654600       1.360200    
 H    6.986900       1.605400     -0.4292000    
 H   -7.084400      0.1987000      0.9708000    


%chk=000010829-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000010829

0 1
O 0.017675 -0.112156 0.612031
O 6.500560 -0.142625 0.522180
O 2.796716 0.899067 -2.411800
O -4.193239 0.591472 2.677239
O 0.444464 0.570198 -1.575467
O -6.379192 -0.879754 -0.626221
O -6.342677 -0.013440 1.497648
C 2.318382 0.071001 -0.123590
C 2.876369 -0.389799 1.131432
C -3.436239 -0.770805 -0.756567
C -1.397189 -0.150348 0.451276
C -4.215134 -0.347840 0.380870
C 3.233065 0.458335 -1.183268
C -2.032765 -0.668669 -0.704542
C 4.269301 -0.437624 1.276011
C 5.144412 -0.043119 0.223989
C -3.529242 0.169960 1.549758
C 0.897019 0.190270 -0.439582
C -2.120497 0.263484 1.574585
C 4.633074 0.403585 -1.006808
C 2.037354 -0.837238 2.316312
C -4.049536 -1.329139 -2.028379
C -5.675672 -0.394566 0.468574
C 7.462523 0.250317 -0.517035
H -1.437607 -0.970069 -1.566800
H 4.718314 -0.783285 2.211163
H -1.622021 0.653948 2.463563
H 5.261388 0.712730 -1.844290
H 1.401216 -0.019277 2.695959
H 1.352457 -1.659284 2.046921
H 2.693271 -1.179538 3.133866
H -4.653604 -2.230885 -1.829337
H -4.733651 -0.603324 -2.500744
H -3.256449 -1.585058 -2.749787
H 1.769143 0.886471 -2.407353
H -5.200652 0.469971 2.519548
H 8.451534 0.093887 -0.063487
H 7.336730 1.314598 -0.791201
H 7.355100 -0.384210 -1.416762
H -7.349901 -0.842139 -0.404103


