%chk=000157140.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157140

0 1
 O   0.8701000      0.1674000     -0.4448000    
 O    2.950300      0.9606000      0.2534000    
 O   0.2796000     -0.1087000       1.824400    
 O    2.148000      -2.038100      -1.673800    
 O    4.911400      -1.402200      -2.473900    
 O    6.367900     -0.2530000     -0.2571000    
 O   -5.230200       1.510200      -1.224300    
 O   -3.378400      0.7106000      -2.445900    
 O    4.201500       2.376500       2.236600    
 O   -2.153000      -3.330400      0.4165000    
 O   -3.540200      -2.394900       2.016600    
 C   -1.210300       1.156000      0.2892000    
 C   -2.062700     -0.1185000      2.7100001E-02
 C    2.217000     -0.1959000     -0.1431000    
 C    2.830100     -0.8146000      -1.399300    
 C    4.320800      -1.096100      -1.209800    
 C    5.044400      0.1202000     -0.6318000    
 C   0.2272000      0.7627000      0.6844000    
 C    4.304800      0.6603000      0.5945000    
 C   -3.555700      0.2085000     -0.1081000    
 C   -1.751300      -1.166100       1.063000    
 C    4.942400       1.943000       1.118900    
 C   -1.791700       2.082500       1.322600    
 C   -3.820700       1.248800      -1.195300    
 C  -0.6778000      -1.088300       1.860200    
 C   -2.598000      -2.348100       1.240900    
 C   -1.648100       3.411900       1.301200    
 C   -5.713700       2.000400      1.9500000E-02
 C   -3.599000       1.594500      -3.536900    
 C   -2.884900      -4.559000      0.4750000    
 H   -1.140100       1.700200     -0.6636000    
 H   -1.728000     -0.5461000     -0.9296000    
 H    2.217000     -0.9363000      0.6674000    
 H    2.673800     -0.1629000      -2.267200    
 H    4.469100      -1.979600     -0.5766000    
 H    5.128400      0.8951000      -1.403700    
 H   0.7755000       1.674100      0.9535000    
 H    4.303500     -7.6200001E-02   1.409800    
 H   -3.946700      0.5047000      0.8698000    
 H   -4.101300     -0.7079000     -0.3737000    
 H    4.918100       2.739300      0.3676000    
 H    5.978800       1.782600       1.429200    
 H   -2.308900       1.644500       2.172900    
 H   -3.303300       2.196000      -1.016400    
 H  -0.4432000      -1.803600       2.637700    
 H    2.274700      -2.631500     -0.9138000    
 H    5.858500      -1.562200      -2.321500    
 H    6.303600     -0.9352000      0.4328000    
 H   -2.066400       4.023200       2.093200    
 H   -1.115600       3.910200      0.4989000    
 H    3.283500       2.517200       1.948000    
 H   -6.652100       2.528100     -0.1763000    
 H   -5.947900       1.175600      0.6981000    
 H   -5.019300       2.709500      0.4813000    
 H   -4.669200       1.748000      -3.702300    
 H   -3.101600       2.553300      -3.361700    
 H   -3.173200       1.140900      -4.436000    
 H   -2.828500      -4.985600       1.481000    
 H   -3.926300      -4.393200      0.1830000    
 H   -2.429700      -5.259900     -0.2299000    


%chk=000157140-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157140

0 1
O 0.935740 0.065815 -0.005225
O 3.027639 1.108728 0.137122
O 0.232089 -0.273017 2.273433
O 2.218669 -2.426713 -0.733649
O 4.734169 -1.998003 -2.070862
O 6.518704 -0.042943 -0.781766
O -5.069842 1.222687 -1.490332
O -2.919415 0.729416 -2.327412
O 4.504816 3.162666 1.485747
O -3.183721 -2.901363 0.139628
O -2.504873 -3.449715 2.296751
C -1.173335 1.025717 0.665954
C -1.928022 -0.276731 0.215692
C 2.327613 -0.201992 0.202707
C 2.818330 -1.111505 -0.932388
C 4.353705 -1.221418 -0.888882
C 5.054197 0.147024 -0.859892
C 0.250050 0.670867 1.127545
C 4.498185 0.996911 0.301895
C -3.422188 0.023684 -0.089297
C -1.727629 -1.365392 1.272747
C 5.011257 2.439580 0.320067
C -1.875987 1.780032 1.784212
C -3.636575 1.115931 -1.143356
C -0.718049 -1.288635 2.195294
C -2.491244 -2.639034 1.331685
C -2.134443 3.110491 1.768111
C -5.807619 2.157971 -0.640526
C -2.999750 1.715399 -3.413330
C -3.909703 -4.191511 0.100792
H -1.060980 1.687178 -0.211920
H -1.463959 -0.613889 -0.730701
H 2.507061 -0.666135 1.196752
H 2.518383 -0.665702 -1.903386
H 4.633308 -1.778574 0.038082
H 4.906914 0.669991 -1.820816
H 0.815144 1.533392 1.518126
H 4.723027 0.510187 1.280720
H -3.953386 0.324028 0.833965
H -3.900264 -0.891542 -0.470234
H 4.716341 2.938166 -0.627339
H 6.109137 2.452449 0.406327
H -2.163831 1.184862 2.663225
H -3.303624 2.127310 -0.798537
H -0.560636 -2.053668 2.959816
H 2.579601 -3.026131 -1.436792
H 5.722165 -1.960784 -2.156513
H 6.748789 -0.418073 0.108963
H -2.623597 3.610641 2.611449
H -1.856567 3.743245 0.914707
H 3.514853 3.103255 1.461862
H -6.810694 2.248724 -1.086652
H -5.906224 1.786051 0.399806
H -5.322645 3.157879 -0.615727
H -4.040028 1.820904 -3.767506
H -2.621105 2.705589 -3.079614
H -2.357678 1.326432 -4.218219
H -3.200263 -5.030112 0.201293
H -4.646631 -4.244254 0.919881
H -4.402378 -4.203866 -0.881682


