%chk=000169710.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169710

0 1
 O   0.3407000      0.7145000       2.458000    
 O   -3.528100       3.018700       1.118900    
 O    3.012700       1.641000      -2.166200    
 O   -1.950300      -1.811200       2.087800    
 O   -3.773100      -3.049100       1.545900    
 C  -0.5167000       1.365000      0.2883000    
 C   -1.598100       2.345600     -0.1906000    
 C  -0.2617000       1.781600       1.743000    
 C   -1.649300       2.085200       2.303300    
 C   -2.401600       2.539600       1.079200    
 C   -2.438400       1.804600      -1.334000    
 C   0.7167000       1.411800     -0.5556000    
 C    2.459400      0.3206000      -2.070200    
 C    1.216300      0.3470000      -1.202600    
 C    3.559700     -0.5786000      -1.457700    
 C   -3.146800      0.4967000      -1.101100    
 C    4.116600     -0.1249000     -0.1027000    
 C    2.081500     -0.1083000      -3.492600    
 C    5.248500      -1.020700      0.4147000    
 C   -3.033900     -0.6247000      -1.829200    
 C   -3.771300      -1.894900      -1.519400    
 C    5.792000     -0.5904000       1.777800    
 C   -2.849700      -3.089300      -1.236400    
 C    6.960100      -1.464300       2.208900    
 C   -1.925100      -2.889400     -3.1800002E-02
 C   -2.660300      -2.625900       1.264300    
 H  -0.9005000      0.3365000      0.3040000    
 H   -1.165400       3.318400     -0.4565000    
 H   0.3873000       2.664100       1.804600    
 H   -2.129900       1.197000       2.723600    
 H   -1.609400       2.880200       3.052000    
 H   -1.806500       1.720700      -2.227700    
 H   -3.210200       2.544800      -1.583100    
 H    1.217200       2.373800     -0.6270000    
 H   0.6976000     -0.6054000      -1.105500    
 H    4.402900     -0.6155000      -2.161000    
 H    3.184600      -1.606500      -1.366900    
 H   0.4098000      0.9902000       3.387900    
 H   -3.826900      0.4808000     -0.2514000    
 H    4.490700      0.9027000     -0.1816000    
 H    3.310500     -0.1135000      0.6404000    
 H    2.952100     -5.7300001E-02  -4.156600    
 H    1.324300      0.5585000      -3.922300    
 H    1.690600      -1.131300      -3.514800    
 H    6.065200      -1.017900     -0.3180000    
 H    4.887100      -2.054500      0.4811000    
 H   -2.370200     -0.6347000      -2.689900    
 H    2.398000       2.195100      -2.677300    
 H   -4.466800      -1.749700     -0.6849000    
 H   -4.393900      -2.140200      -2.388900    
 H    6.122100      0.4539000       1.732800    
 H    4.996300     -0.6479000       2.529300    
 H   -3.474300      -3.975800      -1.070400    
 H   -2.235900      -3.297600      -2.121500    
 H    7.785200      -1.398600       1.492400    
 H    7.332800      -1.142800       3.186400    
 H    6.656400      -2.513000       2.289000    
 H   -1.315400      -3.787800      0.1160000    
 H   -1.239400      -2.059000     -0.2290000    
 H   -2.434300      -1.619400       2.919100    


%chk=000169710-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169710

0 1
O 0.488493 -0.257715 2.052463
O -3.277112 2.767613 1.375398
O 3.183272 1.841927 -2.342056
O -3.615033 -1.410619 2.553215
O -5.089603 -2.805290 1.432600
C -0.322995 0.989478 0.124183
C -1.429133 2.054852 -0.124223
C -0.065026 1.046102 1.658145
C -1.442683 1.361029 2.284423
C -2.198390 2.149130 1.209872
C -2.344184 1.780891 -1.356862
C 0.923052 1.184631 -0.702388
C 2.748899 0.421533 -2.325628
C 1.465065 0.249528 -1.521350
C 3.933649 -0.347560 -1.675383
C -3.219955 0.555130 -1.185174
C 4.272983 0.083303 -0.233423
C 2.532046 -0.058119 -3.782566
C 5.519741 -0.643751 0.318730
C -3.012759 -0.649173 -1.781789
C -3.873711 -1.878058 -1.569442
C 5.866718 -0.230554 1.767317
C -3.150660 -3.016197 -0.789473
C 7.118339 -0.947618 2.318338
C -2.742951 -2.624355 0.648790
C -3.939057 -2.326712 1.531500
H -0.749935 -0.012840 -0.078546
H -0.950717 3.048570 -0.276338
H 0.660460 1.855189 1.893073
H -1.996001 0.411529 2.448917
H -1.416349 1.907833 3.243254
H -1.695350 1.668779 -2.246625
H -2.981880 2.671842 -1.512080
H 1.440650 2.151470 -0.595436
H 0.982344 -0.735964 -1.612391
H 4.817093 -0.191103 -2.326404
H 3.698116 -1.430865 -1.698483
H 0.687520 -0.247388 3.022411
H -4.077367 0.669691 -0.503719
H 4.441749 1.176995 -0.221529
H 3.406808 -0.115374 0.428446
H 3.459274 0.085608 -4.364515
H 1.717749 0.510898 -4.270670
H 2.260185 -1.129340 -3.814903
H 6.391415 -0.436519 -0.337471
H 5.358151 -1.742356 0.283437
H -2.153107 -0.764577 -2.463582
H 2.475040 2.372258 -2.790945
H -4.800785 -1.604213 -1.031413
H -4.186546 -2.288001 -2.550838
H 6.021066 0.867226 1.803226
H 4.997523 -0.443779 2.422912
H -3.820860 -3.894972 -0.749186
H -2.238260 -3.321784 -1.337741
H 8.006526 -0.727114 1.696299
H 7.344838 -0.633121 3.354061
H 6.977151 -2.045244 2.321637
H -2.189547 -3.459981 1.123270
H -2.062454 -1.756797 0.663256
H -4.422004 -1.257482 3.117701


