%chk=000002986.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002986

0 1
 O   -2.266400      -3.701000     -0.8609000    
 O    6.760700     -0.4765000      0.8800000    
 C   -3.402000     -0.8408000       1.380000    
 C   -4.008800      0.2008000      0.4365000    
 C   -3.285100      -2.231000      0.7453000    
 C   -4.129800       1.594100       1.066100    
 C   -2.354700      -2.327500     -0.4725000    
 C   -4.810100       2.656200      0.1964000    
 C  -0.9549000      -1.867300     -0.1693000    
 C   -6.236100       2.327800     -0.1326000    
 C  -0.2526000     -0.9221000     -0.8101000    
 C   -6.699300       2.178200      -1.378500    
 C    1.070700     -0.5423000     -0.4623000    
 C    2.196500     -0.2319000     -0.1842000    
 C    6.016300      0.7264000      0.7207000    
 C    3.490400      0.1019000      0.1254000    
 C    4.626400      0.3860000      0.3916000    
 C    6.586600       1.614500     -0.3519000    
 C    7.652100       1.354600      -1.119800    
 H   -2.421800     -0.4989000       1.731200    
 H   -4.036700     -0.9226000       2.271300    
 H   -4.998100     -0.1515000      0.1218000    
 H   -3.400200      0.2885000     -0.4703000    
 H   -4.283500      -2.586400      0.4581000    
 H   -2.944400      -2.937200       1.515000    
 H   -3.124500       1.951300       1.323100    
 H   -4.676900       1.508900       2.014100    
 H   -2.769700      -1.774200      -1.321800    
 H   -4.794100       3.613600      0.7310000    
 H   -4.222800       2.799400     -0.7190000    
 H  -0.4738000      -2.380700      0.6639000    
 H   -6.927900       2.217000      0.6983000    
 H   -3.164900      -4.000000      -1.082700    
 H  -0.7104000     -0.4012000      -1.646000    
 H   -7.744300       1.945200      -1.551500    
 H   -6.051100       2.282500      -2.241400    
 H    6.057700       1.268000       1.672300    
 H    6.088400       2.571700     -0.4987000    
 H    6.398400     -0.9487000       1.649400    
 H    7.981500       2.077100      -1.858900    
 H    8.213100      0.4312000      -1.034300    


%chk=000002986-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000002986

0 1
O -2.520481 -3.882326 -0.665671
O 7.105619 -0.531348 -0.058283
C -3.390981 -0.724869 1.444699
C -3.996431 0.271598 0.428252
C -3.351319 -2.193190 0.958880
C -4.168289 1.687164 1.022129
C -2.454121 -2.451027 -0.283788
C -4.750912 2.717720 0.015529
C -0.999488 -2.179287 -0.001873
C -6.176965 2.409908 -0.395162
C -0.289516 -1.158392 -0.574175
C -6.621094 2.262990 -1.669066
C 1.074145 -0.859925 -0.300199
C 2.265868 -0.550453 -0.103172
C 6.176516 0.436531 0.560469
C 3.573572 -0.219070 0.118375
C 4.763444 0.084864 0.315596
C 6.506335 1.828823 0.032112
C 7.487106 2.084783 -0.863011
H -2.366774 -0.398706 1.715331
H -3.988347 -0.686442 2.378173
H -4.979178 -0.103204 0.076889
H -3.350867 0.340406 -0.471355
H -4.385030 -2.516926 0.705920
H -2.996565 -2.853760 1.774565
H -3.185887 2.053071 1.383669
H -4.828666 1.633548 1.912971
H -2.802965 -1.823696 -1.130907
H -4.723495 3.721399 0.489688
H -4.104618 2.771328 -0.882554
H -0.518592 -2.859371 0.713712
H -6.895819 2.306365 0.434626
H -3.472222 -4.162321 -0.668976
H -0.792694 -0.512909 -1.311181
H -7.673270 2.051938 -1.892153
H -5.943320 2.355523 -2.527214
H 6.338977 0.436681 1.664231
H 5.884108 2.631452 0.448837
H 6.758603 -1.446235 0.097782
H 7.690446 3.107404 -1.199642
H 8.097067 1.273060 -1.269251


