%chk=000159819.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159819

0 1
 O   -2.566500     -1.4300000E-02 -0.8207000    
 O   -2.198100     -0.1087000       2.050300    
 O   -5.034600       1.896000      0.9728000    
 O   -4.329700      -1.653200      0.9462000    
 O    4.980800      0.5020000     -1.2900000E-02
 O  -0.6150000       3.661000      9.6600004E-02
 O   -3.837100      0.7629000      -3.144800    
 O    4.813100       2.900100      9.3800001E-02
 O  -0.3186000      -3.900300     -0.2463000    
 N  -0.8411000       1.303300     -1.1500000E-02
 C   -2.271200       1.132700     -2.7700000E-02
 C   -2.835800      0.9826000       1.386300    
 C   -4.342000      0.7084000       1.344400    
 C   -4.694000     -0.4047000      0.3498000    
 C   -3.963300     -0.2807000     -0.9985000    
 C   0.1009000      0.2612000     -5.2900001E-02
 C    1.354300      0.8032000     -2.0800000E-02
 C    1.259200       2.180400      4.0700000E-02
 C  -0.1774000       2.527500      4.7699999E-02
 C    2.543400      7.0900001E-02 -4.6900000E-02
 C   -4.598300      0.7298000      -1.951700    
 C  -6.7400001E-02  -1.105700     -0.1160000    
 C    2.397700      -1.362900     -0.1128000    
 C    1.077800      -1.929000     -0.1466000    
 C    3.678900      0.9105000     -2.3000001E-03
 C    2.379900       2.982200      8.3300002E-02
 C    3.587700       2.302400      5.9799999E-02
 C   0.9199000      -3.321800     -0.2112000    
 C    3.491000      -2.254600     -0.1469000    
 C    5.684400       1.756200      4.7300000E-02
 C    2.024700      -4.169600     -0.2435000    
 C    3.306500      -3.637400     -0.2114000    
 C  -0.9099000      -4.230200       1.006300    
 H   -2.692300       2.027300     -0.4999000    
 H   -2.621700       1.891000       1.962000    
 H   -4.691900      0.4233000       2.344200    
 H   -5.775600     -0.4370000      0.1728000    
 H   -3.988400      -1.258300      -1.497000    
 H   -4.624200       1.744800      -1.549100    
 H   -5.623100      0.4381000      -2.201300    
 H   -1.053100      -1.552900     -0.1198000    
 H    2.324300       4.061500      0.1315000    
 H   -2.552500     -0.1498000       2.954700    
 H   -4.816300       2.580800       1.627600    
 H   -4.854100      -1.755200       1.758700    
 H    4.513800      -1.890300     -0.1242000    
 H    6.327200       1.840200     -0.8365000    
 H    6.317400       1.760400      0.9420000    
 H   -2.929800       1.021600      -2.909000    
 H    1.892000      -5.246900     -0.2950000    
 H    4.169100      -4.297200     -0.2368000    
 H   -1.930100      -4.578300      0.8223000    
 H  -0.9539000      -3.359300       1.668000    
 H  -0.3487000      -5.036200       1.489500    


%chk=000159819-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000159819

0 1
O -2.762175 0.168541 -0.979639
O -2.646692 -0.955092 1.751379
O -4.927522 2.003430 1.208760
O -4.908341 -1.586498 0.276687
O 5.074876 0.550022 -0.203030
O -0.887354 3.480382 0.071566
O -3.888404 1.652642 -3.153757
O 4.830388 2.927921 -0.231407
O -0.033200 -4.171400 0.281246
N -0.888863 1.087459 0.153153
C -2.329544 0.998731 0.173067
C -2.967381 0.442349 1.469251
C -4.512517 0.602266 1.349392
C -5.035090 -0.116702 0.076724
C -4.237749 0.203505 -1.202003
C 0.087915 0.055294 0.119586
C 1.366626 0.708999 0.037676
C 1.203125 2.115070 0.003588
C -0.253840 2.387637 0.070175
C 2.602899 0.012161 -0.033906
C -4.627594 1.524329 -1.897579
C 0.022418 -1.322877 0.127796
C 2.565726 -1.446081 0.009507
C 1.262949 -2.079072 0.106683
C 3.705054 0.894211 -0.140021
C 2.320732 2.971401 -0.096002
C 3.554610 2.304445 -0.165972
C 1.218871 -3.510969 0.183914
C 3.740845 -2.249684 -0.044788
C 5.793763 1.831257 -0.466880
C 2.385709 -4.285602 0.118767
C 3.650196 -3.650583 -0.003805
C -0.575440 -4.252570 1.655252
H -2.681586 2.045070 0.054605
H -2.581789 1.017493 2.331260
H -4.978308 0.139537 2.246081
H -6.096592 0.161800 -0.075079
H -4.396322 -0.624849 -1.914326
H -4.465254 2.397200 -1.236510
H -5.693551 1.497422 -2.182545
H -0.923250 -1.862050 0.140304
H 2.239023 4.060056 -0.122294
H -3.199084 -1.511773 1.126097
H -4.651358 2.518249 2.008188
H -5.610132 -1.899125 0.901963
H 4.716329 -1.762165 -0.121909
H 6.115831 1.841348 -1.525129
H 6.629841 1.921909 0.242752
H -2.930568 1.484960 -2.949707
H 2.298142 -5.375969 0.159190
H 4.558845 -4.259454 -0.058175
H -1.522592 -4.806432 1.564657
H -0.765858 -3.245527 2.074419
H 0.121533 -4.804823 2.315379


