%chk=000026346.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026346

0 1
 O   0.1766000     -0.4291000      -2.537000    
 O   -1.103500       1.419300       1.698800    
 C   -2.201600      -1.132600      0.5401000    
 C   -1.883900     -0.1077000     -0.5851000    
 C   -3.698000      -1.467700      0.5553000    
 C   -4.545000     -0.2129000      0.7768000    
 C   -2.931200      0.9803000     -0.7035000    
 C  -0.4886000      0.4853000     -0.4222000    
 C   -4.120300      0.9524000     -7.7200003E-02
 C   -1.402600      -2.394900      0.3881000    
 C   0.4668000      0.2884000      -1.415300    
 C  -0.1781000       1.220300      0.7184000    
 C   -5.103600       2.079600     -0.1931000    
 C   -1.612300      -3.161200     -0.8842000    
 C    2.058800       1.568400     -0.1255000    
 C    1.743000      0.8312000      -1.266700    
 C    1.098200       1.763000      0.8670000    
 C    3.423400       2.148400      3.3100002E-02
 C  -0.5501000      -2.812800       1.335400    
 C    4.429600       1.222800      0.7411000    
 C    4.694000     -7.1300000E-02 -3.4600001E-02
 C    5.716200     -0.9503000      0.6871000    
 C    6.012000      -2.218900     -9.7000003E-02
 H   -1.987200     -0.7084000       1.527400    
 H   -1.972800     -0.6251000      -1.543300    
 H   -3.927100      -2.200200       1.339700    
 H   -4.011400      -1.915300     -0.3962000    
 H   -4.487900      8.7200001E-02   1.830400    
 H   -5.592500     -0.4639000      0.5704000    
 H   -2.686600       1.830700      -1.337100    
 H   -6.036400       1.725700     -0.6436000    
 H   -4.723200       2.898300     -0.8129000    
 H   -5.328300       2.488600      0.7973000    
 H   -2.653000      -3.470000      -1.010300    
 H   -1.297600      -2.600700      -1.766400    
 H   -1.020200      -4.084600     -0.8853000    
 H    2.484600      0.6788000      -2.047200    
 H    1.346500       2.335900       1.757400    
 H    3.820500       2.433200     -0.9503000    
 H    3.355800       3.088300      0.5966000    
 H   2.3499999E-02  -3.725900       1.215600    
 H  -0.4027000      -2.252000       2.252300    
 H    4.060400      0.9787000       1.745100    
 H    5.372400       1.768300      0.8703000    
 H    3.769900     -0.6479000     -0.1461000    
 H    5.056900      0.1699000      -1.040900    
 H  -0.6845000     -0.1365000      -2.878800    
 H  -0.7048000       1.949500       2.409800    
 H    5.340500      -1.219300       1.681200    
 H    6.649400     -0.3938000      0.8323000    
 H    6.421100      -1.983300      -1.084700    
 H    6.744800      -2.832200      0.4367000    
 H    5.104800      -2.815900     -0.2340000    


%chk=000026346-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000026346

0 1
O -0.030297 -0.075885 -2.874458
O -0.920534 1.248544 1.756894
C -2.262259 -1.151115 0.461634
C -1.981201 -0.028855 -0.594486
C -3.768641 -1.531862 0.385867
C -4.660936 -0.332487 0.775506
C -3.034617 1.078469 -0.524399
C -0.560073 0.535465 -0.524386
C -4.243478 0.960340 0.086909
C -1.354643 -2.372960 0.315673
C 0.331203 0.489185 -1.633324
C -0.051266 1.162121 0.646334
C -5.233899 2.106371 0.145284
C -1.282660 -3.067069 -1.036402
C 2.125628 1.607108 -0.396894
C 1.646771 1.005141 -1.577882
C 1.256186 1.686652 0.719918
C 3.544120 2.154200 -0.306461
C -0.651314 -2.840765 1.381496
C 4.487783 1.294270 0.583517
C 4.763133 -0.116757 0.018866
C 5.700262 -0.953348 0.919634
C 5.988715 -2.357531 0.345866
H -2.079375 -0.708444 1.457207
H -2.112046 -0.520763 -1.589475
H -3.965090 -2.388566 1.057651
H -4.023038 -1.859606 -0.642685
H -4.627086 -0.179873 1.875806
H -5.721339 -0.554499 0.535122
H -2.763066 2.026585 -1.009697
H -6.191777 1.835488 -0.342506
H -4.842479 3.014181 -0.345923
H -5.477104 2.364646 1.195794
H -2.288453 -3.244997 -1.463364
H -0.712880 -2.462415 -1.770042
H -0.770704 -4.041278 -0.954555
H 2.272650 0.930993 -2.471909
H 1.603901 2.162130 1.647818
H 3.978563 2.226730 -1.322043
H 3.515321 3.183825 0.103272
H -0.023206 -3.737215 1.311809
H -0.680407 -2.332074 2.352664
H 4.049998 1.202990 1.598854
H 5.449952 1.833838 0.702946
H 3.804149 -0.655435 -0.115600
H 5.213464 -0.024568 -0.992182
H -0.985702 -0.338155 -2.871684
H -0.479088 1.741973 2.492035
H 5.244012 -1.050775 1.926218
H 6.655529 -0.407066 1.062853
H 6.473330 -2.287791 -0.646431
H 6.656691 -2.938411 1.008519
H 5.051994 -2.932583 0.220024


