%chk=000002898.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002898

0 1
 O    4.934800       2.074100     -0.2137000    
 O   -4.929500       2.079400     -0.2147000    
 O    6.010900      2.3800001E-02  0.1301000    
 O   -6.007800      2.9700000E-02  0.1260000    
 C  -1.4400000E-02  -4.700200     -0.2660000    
 C   -1.278000      -3.848300     -0.3963000    
 C    1.251400      -3.855400     -0.4200000    
 C   -1.272100      -2.669300      0.5778000    
 C    1.270100      -2.676000      0.5535000    
 C  -1.9999999E-04  -1.873400      0.4446000    
 C   1.2000001E-03 -0.5508000      0.2245000    
 C    1.310900      0.1455000      0.1079000    
 C   -1.307500      0.1470000      0.1083000    
 C    1.895500      0.6551000       1.247500    
 C   -1.891900      0.2594000      -1.135300    
 C    1.895700      0.2576000      -1.135400    
 C   -1.892100      0.6575000       1.247700    
 C    3.123300       1.308300       1.138700    
 C   -3.119000      0.9139000      -1.244600    
 C    3.123300      0.9109000      -1.244600    
 C   -3.119000       1.312200       1.138300    
 C    3.737000       1.436400     -0.1074000    
 C   -3.732300       1.440500     -0.1078000    
 C    6.048800       1.230100     -7.2999999E-02
 C   -6.044300       1.236600     -7.3899999E-02
 C    7.314500       2.023800     -0.2052000    
 C   -7.309200       2.031600     -0.2069000    
 H  -6.5000001E-03  -5.194000      0.7135000    
 H  -2.3700001E-02  -5.491700      -1.023800    
 H   -2.159300      -4.473200     -0.2117000    
 H   -1.360700      -3.474800      -1.424900    
 H    1.317000      -3.482500      -1.450100    
 H    2.132600      -4.485100     -0.2517000    
 H   -1.324600      -3.055100       1.604600    
 H   -2.196900      -2.108300      0.4268000    
 H    2.194400      -2.119500      0.3843000    
 H    1.340400      -3.061700       1.579300    
 H    1.426800      0.5605000       2.223000    
 H   -1.423700     -0.1479000      -2.026900    
 H    1.427100     -0.1489000      -2.027300    
 H   -1.423800      0.5626000       2.223300    
 H    3.595800       1.715500       2.028400    
 H   -3.591400       1.010400      -2.218500    
 H    3.596000       1.007200      -2.218300    
 H   -3.591200       1.720200       2.027900    
 H    7.355000       2.492100      -1.191700    
 H    8.174300       1.356000     -9.9799998E-02
 H    7.359900       2.779600      0.5826000    
 H   -7.349300       2.794700      0.5743000    
 H   -8.169700       1.366700     -9.0300001E-02
 H   -7.353800       2.490900      -1.197300    


%chk=000002898-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000002898

0 1
O 4.658631 2.238920 -0.170270
O -4.965791 1.728708 -0.460007
O 6.027484 1.565645 1.628467
O -4.805279 3.527909 1.057052
C -0.016636 -5.357471 -0.533818
C -1.313378 -4.519691 -0.449627
C 1.211036 -4.453273 -0.785150
C -1.173636 -3.387450 0.606221
C 1.334454 -3.328398 0.285745
C 0.048893 -2.511823 0.354640
C -0.001994 -1.143027 0.183925
C 1.234492 -0.292129 0.127527
C -1.293895 -0.388894 0.049925
C 2.255466 -0.390518 1.110277
C -2.299525 -0.782365 -0.877423
C 1.398829 0.680954 -0.898335
C -1.529203 0.784090 0.816204
C 3.416177 0.413532 1.075972
C -3.495503 -0.052458 -1.009356
C 2.548819 1.488477 -0.958781
C -2.722833 1.529928 0.707127
C 3.554840 1.348650 0.024144
C -3.705770 1.095629 -0.213641
C 5.818789 2.286959 0.631836
C -5.432689 2.894912 0.184100
C 6.748790 3.344086 0.077779
C -6.803385 3.234237 -0.359548
H 0.123480 -5.905526 0.421253
H -0.101925 -6.120570 -1.331649
H -2.174625 -5.165688 -0.190985
H -1.528192 -4.073635 -1.442390
H 1.124842 -3.985484 -1.786752
H 2.139594 -5.056461 -0.788457
H -1.037929 -3.872032 1.598541
H -2.100024 -2.793896 0.667669
H 2.207004 -2.696650 0.053145
H 1.527424 -3.807995 1.269521
H 2.131562 -1.098989 1.936803
H -2.129099 -1.655861 -1.515802
H 0.618542 0.797906 -1.658075
H -0.762236 1.119813 1.522875
H 4.185072 0.321271 1.843097
H -4.267791 -0.349362 -1.725373
H 2.683929 2.228390 -1.753469
H -2.883963 2.419751 1.315743
H 7.048831 3.082002 -0.951880
H 7.640593 3.420478 0.715967
H 6.234228 4.319074 0.031000
H -6.753181 3.386101 -1.451555
H -7.176395 4.146270 0.127813
H -7.502124 2.399655 -0.176224


