%chk=000125299.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125299

0 1
 O  -0.4370000     -0.5757000      0.3925000    
 O   -1.816500      0.5138000      -1.201600    
 O    2.884100      0.9030000     -5.0299998E-02
 O    1.236900      -2.893600     -4.4799998E-02
 O   0.7854000       1.859400     -0.4105000    
 O    3.418500      -1.642900      -1.230200    
 O   -3.406300      -1.880200      -1.244800    
 O   -4.608600      -1.375900       1.213800    
 O   -4.369500       1.467500       1.280700    
 O    5.472400       1.466500      0.6731000    
 C   0.8985000     -0.5102000     -0.1072000    
 C    1.713900      -1.659600      0.4844000    
 C   -1.396500     -0.7372000     -0.6464000    
 C    3.202100      -1.493900      0.1745000    
 C   -2.596600      -1.524100     -0.1230000    
 C   -3.411500     -0.6855000      0.8631000    
 C    1.499400      0.8404000      0.2888000    
 C    3.669400     -9.9699996E-02  0.6066000    
 C   -3.771800      0.6726000      0.2595000    
 C   -2.510500       1.361100     -0.2803000    
 C    5.128600      0.1591000      0.2502000    
 C   -2.838100       2.653400      -1.023100    
 C    1.253700       3.181600     -0.1251000    
 H   0.9085000     -0.5874000      -1.202900    
 H    1.567300      -1.699500       1.571100    
 H  -0.9744000      -1.318700      -1.476200    
 H    3.781300      -2.280100      0.6701000    
 H   -2.282600      -2.456100      0.3593000    
 H   -2.842600     -0.5441000       1.790500    
 H    1.371700       1.016700       1.365200    
 H    3.542400      3.0800000E-02   1.689300    
 H   -4.520100      0.5369000     -0.5308000    
 H   -1.839700       1.620100      0.5487000    
 H    5.303000      0.1098000     -0.8294000    
 H    5.791300     -0.5550000      0.7476000    
 H   -3.517100       2.460700      -1.861000    
 H   -3.294600       3.397500     -0.3645000    
 H   -1.927900       3.087300      -1.451500    
 H   0.2949000      -2.965300      0.1856000    
 H    3.062300     -0.8584000      -1.680100    
 H   -3.568000      -1.080200      -1.772700    
 H   -5.107400     -0.8035000       1.821700    
 H   -4.741300       2.260600      0.8600000    
 H    1.214500       3.375000      0.9508000    
 H   0.5963000       3.890900     -0.6347000    
 H    2.271400       3.318600     -0.5012000    
 H    4.869500       2.087300      0.2292000    


%chk=000125299-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125299

0 1
O -0.487093 -0.725037 0.418357
O -1.886535 0.092091 -1.409533
O 2.858516 0.956745 0.037447
O 1.269694 -2.906890 -0.465261
O 0.716240 1.937637 0.004782
O 3.375740 -1.247559 -1.688987
O -3.699241 -2.112441 -0.780326
O -4.504139 -0.859478 1.773960
O -4.157032 1.857019 1.062632
O 5.487397 1.472959 0.925748
C 0.850759 -0.474508 -0.156698
C 1.751018 -1.689053 0.180621
C -1.521149 -1.045993 -0.565709
C 3.217118 -1.436809 -0.245844
C -2.764566 -1.553242 0.199696
C -3.338372 -0.390315 1.036969
C 1.437270 0.805955 0.471854
C 3.705742 -0.180472 0.512824
C -3.682536 0.809114 0.135623
C -2.426792 1.264501 -0.645651
C 5.151559 0.232670 0.222329
C -2.690052 2.349681 -1.686822
C 1.070611 3.196486 0.687043
H 0.768247 -0.335335 -1.251176
H 1.739675 -1.812967 1.288302
H -1.163069 -1.799058 -1.291301
H 3.822724 -2.327349 -0.005668
H -2.515401 -2.396078 0.863095
H -2.541563 -0.058304 1.738665
H 1.429392 0.741751 1.587772
H 3.569419 -0.296825 1.609610
H -4.494462 0.530467 -0.571086
H -1.648767 1.590191 0.068972
H 5.303741 0.325974 -0.871085
H 5.845897 -0.529408 0.613525
H -3.453366 2.026069 -2.418136
H -3.032412 3.281424 -1.199673
H -1.759027 2.574382 -2.233147
H 0.442193 -3.196868 -0.003094
H 3.052657 -0.331541 -1.904686
H -3.795562 -1.457055 -1.521060
H -4.906606 -0.057724 2.200130
H -4.671328 2.536843 0.561183
H 0.974101 3.088380 1.786115
H 0.350889 3.943671 0.321081
H 2.098976 3.503594 0.428969
H 4.808194 2.146505 0.661637


