%chk=000061386.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061386

0 1
 O   -4.299900      0.3673000     -0.1357000    
 O   -3.233400      -1.666600     -0.3506000    
 C    3.114200      0.4523000     -7.7500001E-02
 C    4.380800     -0.4026000     -0.1512000    
 C    1.855700     -0.4173000     -0.1214000    
 C    5.673800      0.4079000     -1.8700000E-02
 C   0.5871000      0.4373000     -8.1100002E-02
 C    6.975600     -0.4011000      2.7999999E-03
 C  -0.6707000     -0.4335000     -0.1597000    
 C    8.225000      0.4616000      0.1978000    
 C   -1.955800      0.3941000     -0.1495000    
 C    9.529000     -0.3377000      0.1293000    
 C   -8.088600      0.1650000     -5.3700000E-02
 C   -6.668800      0.7544000     -4.8799999E-02
 C   -5.569000     -0.2935000     -0.1713000    
 C   -3.209000     -0.4489000     -0.2360000    
 C    10.77700      0.5158000      0.2937000    
 C   -9.168400       1.246200      9.2000002E-03
 C   -8.254600     -0.8004000       1.122200    
 H    3.105900       1.163600     -0.9120000    
 H    3.119900       1.039600      0.8486000    
 H    4.397700     -0.9518000      -1.100500    
 H    4.354900      -1.154000      0.6479000    
 H    1.857700      -1.113000      0.7265000    
 H    1.861200      -1.022200      -1.036400    
 H    5.720900       1.130600     -0.8432000    
 H    5.620200      0.9982000      0.9051000    
 H   0.5682000       1.027800      0.8427000    
 H   0.5934000       1.145200     -0.9186000    
 H    6.924000      -1.145300      0.8069000    
 H    7.060700     -0.9577000     -0.9385000    
 H  -0.6386000      -1.041600      -1.072700    
 H  -0.6834000      -1.137200      0.6822000    
 H    8.245500       1.242600     -0.5722000    
 H    8.163600      0.9733000       1.166100    
 H   -1.954900       1.083700      -1.001200    
 H   -2.002400      0.9772000      0.7774000    
 H    9.521900      -1.109300      0.9084000    
 H    9.584300     -0.8596000     -0.8335000    
 H   -8.233000     -0.3979000     -0.9846000    
 H   -6.566400       1.470300     -0.8749000    
 H   -6.506200       1.342500      0.8642000    
 H   -5.670700     -0.8382000      -1.116900    
 H   -5.604000      -1.000800      0.6628000    
 H    11.67480     -0.1075000      0.2370000    
 H    10.83740       1.274000     -0.4933000    
 H    10.77560       1.025600       1.262300    
 H   -9.074100       1.934500     -0.8371000    
 H   -10.16910      0.8031000     -2.8999999E-02
 H   -9.089800       1.831400      0.9317000    
 H   -9.294000      -1.139400       1.198500    
 H   -7.642300      -1.698600      0.9997000    
 H   -7.988200     -0.3251000       2.072300    


%chk=000061386-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000061386

0 1
O -4.361293 0.353253 -0.027196
O -3.304591 -1.693532 -0.380569
C 3.178077 0.424220 0.004519
C 4.479973 -0.408245 0.016096
C 1.897934 -0.440766 -0.021325
C 5.759678 0.457782 0.038986
C 0.597616 0.393881 -0.037408
C 7.062765 -0.373180 0.046753
C -0.677417 -0.476730 -0.071369
C 8.342039 0.493620 0.068177
C -1.962512 0.373182 -0.085435
C 9.645784 -0.337221 0.073637
C -8.201984 0.210533 -0.120614
C -6.755071 0.737005 0.087345
C -5.685129 -0.334939 -0.125909
C -3.231559 -0.458707 -0.181732
C 10.918006 0.537667 0.094875
C -9.208462 1.380636 -0.012473
C -8.569046 -0.914189 0.878882
H 3.182844 1.097933 -0.878071
H 3.157483 1.083554 0.897687
H 4.500318 -1.068338 -0.876372
H 4.476995 -1.081163 0.899135
H 1.891350 -1.112990 0.861955
H 1.919476 -1.101295 -0.913136
H 5.761107 1.132157 -0.843064
H 5.740447 1.116581 0.932535
H 0.575880 1.052408 0.856476
H 0.608811 1.068100 -0.919834
H 7.062244 -1.047219 0.929058
H 7.081917 -1.032265 -0.846596
H -0.663110 -1.132579 -0.962581
H -0.692813 -1.153732 0.804702
H 8.343207 1.168621 -0.813446
H 8.325151 1.151931 0.962189
H -1.954042 1.074641 -0.944227
H -2.032403 1.010853 0.816688
H 9.643660 -1.011416 0.954538
H 9.661617 -0.994553 -0.819798
H -8.269654 -0.206557 -1.148626
H -6.563414 1.567628 -0.619330
H -6.657510 1.154476 1.109106
H -5.761372 -0.806907 -1.123964
H -5.715896 -1.133720 0.635741
H 11.835814 -0.078896 0.098595
H 10.958156 1.198921 -0.791428
H 10.939824 1.182330 0.993976
H -8.977531 2.181012 -0.740022
H -10.241694 1.035146 -0.201037
H -9.180983 1.825704 1.000929
H -9.621345 -1.226744 0.746379
H -7.937607 -1.812081 0.750101
H -8.451030 -0.561514 1.922007


