%chk=000002977.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002977

0 1
 O  -0.6906000       1.896500      0.3014000    
 O  -0.1704000      -2.832000     -0.7702000    
 C   -2.547300      0.8498000     -0.9731000    
 C   -2.005600     -0.5630000     -0.6802000    
 C   -2.122100       1.892300      0.1045000    
 C   -4.049200      0.7986000      -1.317400    
 C   -2.852200      -1.389500      0.3107000    
 C  -0.5695000     -0.4873000     -0.2270000    
 C   -4.335300      -1.155600      0.2261000    
 C  -1.7100001E-02  0.7108000      0.2329000    
 C   -2.426400       3.320900     -0.3953000    
 C   -2.779300       1.738600       1.482400    
 C   -4.861300     -0.1717000     -0.5184000    
 C   0.2376000      -1.636300     -0.2662000    
 C    1.322300      0.7585000      0.6354000    
 C   -5.196600      -2.087900       1.026500    
 C    2.112900     -0.3885000      0.5939000    
 C    1.570100      -1.587500      0.1433000    
 C    3.541000     -0.3265000       1.019000    
 C    4.526900      2.2399999E-02 -0.1114000    
 C    5.987500      1.1400000E-02  0.3502000    
 C    6.935400      0.3367000     -0.8048000    
 C    8.389200      0.2895000     -0.3623000    
 H   -2.038000       1.175300      -1.895600    
 H   -2.022800      -1.095500      -1.643700    
 H   -4.154900      0.5106000      -2.371800    
 H   -4.504900       1.789100      -1.234200    
 H   -2.531000      -1.215500       1.344400    
 H   -2.661600      -2.454600      0.1221000    
 H   -3.498400       3.528300     -0.4530000    
 H   -1.977300       4.069200      0.2695000    
 H   -1.983700       3.491100      -1.383500    
 H   -2.470400       2.556200       2.145800    
 H   -3.871000       1.754600       1.424400    
 H   -2.459700      0.8274000       1.992000    
 H   -5.940600     -5.1199999E-02 -0.5666000    
 H    1.746100       1.699200      0.9807000    
 H   -5.050600      -3.120600      0.6935000    
 H   -6.261900      -1.853700      0.9288000    
 H   -4.937900      -2.024700       2.088500    
 H    2.196400      -2.475600      9.6500002E-02
 H    3.648900      0.4055000       1.830500    
 H    3.827300      -1.289000       1.463600    
 H    4.278400       1.011000     -0.5181000    
 H    4.402000     -0.6938000     -0.9337000    
 H   0.5457000      -3.486700     -0.7087000    
 H    6.122900      0.7411000       1.157500    
 H    6.232600     -0.9756000      0.7609000    
 H    6.710600       1.333700      -1.201100    
 H    6.786700     -0.3787000      -1.622000    
 H    8.654600     -0.7059000      7.8999996E-03
 H    9.049200      0.5265000      -1.202700    
 H    8.580100       1.015100      0.4349000    


%chk=000002977-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000002977

0 1
O -0.659000 1.909591 0.301542
O -0.368460 -2.874664 -0.617632
C -2.528621 0.858370 -0.961699
C -2.031105 -0.576775 -0.619046
C -2.164148 1.921779 0.121739
C -4.027796 0.843649 -1.371776
C -2.936142 -1.366848 0.375631
C -0.586043 -0.528730 -0.148621
C -4.424355 -1.151658 0.167924
C 0.015358 0.680433 0.288462
C -2.419005 3.356916 -0.375986
C -2.792434 1.713124 1.514432
C -4.896511 -0.143983 -0.614014
C 0.238141 -1.681117 -0.156249
C 1.368789 0.730299 0.705706
C -5.344767 -2.111787 0.896537
C 2.165881 -0.433574 0.692393
C 1.586873 -1.653514 0.257022
C 3.632844 -0.374275 1.093109
C 4.569269 -0.033670 -0.100162
C 6.059145 0.022066 0.303651
C 6.997042 0.365805 -0.876407
C 8.485243 0.417483 -0.467527
H -1.948607 1.180784 -1.851805
H -2.060985 -1.150188 -1.567673
H -4.092085 0.605018 -2.455119
H -4.460866 1.859243 -1.280614
H -2.674891 -1.117664 1.424044
H -2.693689 -2.441798 0.266168
H -3.493221 3.608422 -0.341782
H -1.879596 4.065937 0.275460
H -2.053457 3.491173 -1.409280
H -2.581620 2.589294 2.152283
H -3.885835 1.583352 1.435733
H -2.373444 0.824648 2.013226
H -5.983184 -0.031383 -0.743676
H 1.776845 1.690729 1.036881
H -5.166162 -3.156648 0.573203
H -6.409258 -1.875398 0.721885
H -5.162817 -2.086243 1.989962
H 2.190262 -2.571538 0.245478
H 3.776292 0.388685 1.883302
H 3.948985 -1.344929 1.524780
H 4.261766 0.939510 -0.532680
H 4.427066 -0.787909 -0.900463
H 0.297109 -3.605565 -0.644469
H 6.194306 0.774059 1.109427
H 6.360903 -0.954791 0.737441
H 6.695845 1.342186 -1.307497
H 6.859182 -0.384650 -1.681518
H 8.817465 -0.555363 -0.057936
H 9.134429 0.660928 -1.328767
H 8.655866 1.184178 0.311775


