%chk=000158125.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158125

0 1
 O    1.504500       1.835000     -0.1333000    
 O    3.185800       2.888100       1.055200    
 O   -4.658500       1.068800       1.376500    
 C    4.443400      8.4700003E-02  0.8101000    
 C    3.269200     -0.4900000      9.4300002E-02
 C    3.664600      0.9252000     -0.1589000    
 C    4.284900      0.3292000       2.273300    
 C    5.830300     -0.3040000      0.4184000    
 C    3.479800      -1.469700     -0.9887000    
 C    2.774900       1.994900      0.3284000    
 C    3.619400      -2.804400     -0.8766000    
 C    3.580400      -3.541800      0.4320000    
 C    3.829000      -3.669200      -2.088400    
 C   0.5675000       2.830300      0.2904000    
 C  -0.7777000       2.517900     -0.2965000    
 C   -1.663400       1.707400      0.4046000    
 C   -1.125900       3.041100      -1.536800    
 C   -2.913400       1.416300     -0.1416000    
 C   -2.375900       2.749900      -2.083000    
 C   -3.269800       1.937300      -1.385400    
 C   -3.845900      0.5688000      0.5846000    
 C   -3.874600     -0.9159000      0.4190000    
 C   -2.983700      -1.499000     -0.4515000    
 C   -4.790600      -1.640100       1.145900    
 C   -3.010200      -2.885200     -0.6040000    
 C   -4.817200      -3.026400      0.9934000    
 C   -3.926900      -3.649000      0.1185000    
 H    2.358900     -0.6636000      0.6605000    
 H    4.152900       1.166500      -1.098700    
 H    3.246000      0.5093000       2.571100    
 H    4.631300     -0.5405000       2.842800    
 H    4.880100       1.193200       2.588100    
 H    6.092100      -1.279100      0.8435000    
 H    5.972800     -0.3611000     -0.6663000    
 H    6.552000      0.4298000      0.7947000    
 H    3.511700      -1.047100      -1.992100    
 H    2.766300      -4.274000      0.4286000    
 H    4.524100      -4.073200      0.5933000    
 H    3.424900      -2.880100       1.289000    
 H    4.779800      -4.206600      -2.010300    
 H    3.020800      -4.402700      -2.174900    
 H    3.851200      -3.088000      -3.016300    
 H   0.5101000       2.841900       1.386100    
 H   0.9047000       3.820800     -3.9799999E-02
 H   -1.384500       1.299200       1.373200    
 H  -0.4366000       3.673100      -2.089800    
 H   -2.653000       3.155200      -3.051700    
 H   -4.241100       1.717100      -1.820800    
 H   -2.256700     -0.9391000      -1.029400    
 H   -5.492900      -1.178600       1.832700    
 H   -2.316900      -3.370500      -1.284900    
 H   -5.530800      -3.621300       1.556000    
 H   -3.947400      -4.728400     -9.9999997E-05


%chk=000158125-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000158125

0 1
O 1.470819 1.294812 -0.275538
O 3.103752 2.652257 0.689965
O -5.185919 0.489079 0.358113
C 3.158521 -1.104872 0.852036
C 3.369178 -0.903352 -0.659280
C 3.593352 0.299718 0.321890
C 1.732695 -1.330514 1.351023
C 4.210971 -1.849591 1.674144
C 4.516747 -1.465883 -1.416869
C 2.745533 1.516345 0.288870
C 4.523391 -1.843813 -2.730680
C 3.330901 -1.747108 -3.665633
C 5.781858 -2.410010 -3.367544
C 0.586895 2.508697 -0.334507
C -0.770791 2.053203 -0.809303
C -1.660750 1.409896 0.085096
C -1.175308 2.264343 -2.149847
C -2.940705 0.977836 -0.345341
C -2.456910 1.852538 -2.586477
C -3.337702 1.219981 -1.689010
C -3.942437 0.344288 0.583074
C -3.485244 -0.456197 1.771024
C -2.258019 -1.173115 1.790086
C -4.361166 -0.553028 2.886544
C -1.909573 -1.958755 2.910516
C -4.006164 -1.326279 4.008937
C -2.777149 -2.030687 4.024728
H 2.430177 -0.811422 -1.214420
H 4.634947 0.559319 0.537863
H 0.997216 -0.774823 0.747709
H 1.489672 -2.409383 1.298467
H 1.629065 -1.008472 2.405316
H 4.070950 -2.943073 1.578492
H 5.242789 -1.614034 1.361994
H 4.117293 -1.585081 2.743789
H 5.454404 -1.583496 -0.853556
H 3.579586 -1.122117 -4.546371
H 3.060840 -2.748190 -4.057097
H 2.434731 -1.316593 -3.191257
H 5.602939 -3.428918 -3.765998
H 6.106197 -1.788756 -4.226493
H 6.619181 -2.465458 -2.650429
H 0.559729 2.958353 0.674174
H 1.050449 3.236160 -1.023589
H -1.360481 1.272194 1.129894
H -0.489768 2.756198 -2.850339
H -2.764333 2.029341 -3.622548
H -4.341804 0.911885 -1.998286
H -1.593234 -1.144618 0.920666
H -5.315723 -0.018039 2.845128
H -0.966677 -2.516607 2.910851
H -4.682523 -1.385668 4.868539
H -2.502597 -2.636093 4.895883


