%chk=000174868.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174868

0 1
 O  -0.1760000       1.584000      -2.057000    
 O   -3.142400     -0.2160000      0.3249000    
 O   -2.665000       2.575700      0.8826000    
 O    3.540700     -0.5435000     -0.1892000    
 O   -3.783700      -2.039800       1.571100    
 O    4.722000     -5.1899999E-02   1.734300    
 C  -0.9763000      0.9399000      0.1784000    
 C   0.2586000       1.318400     -0.7025000    
 C   -2.052500      0.1129000     -0.5789000    
 C    1.388500      0.2633000     -0.8499000    
 C   0.7292000       2.672500     -0.1363000    
 C   -1.686400      -1.231200      -1.212700    
 C   -1.538400       2.348700      0.4544000    
 C   0.9047000      -1.193500      -1.011000    
 C  -0.5504000       3.447500      0.1551000    
 C  -0.3240000      -1.398700      -1.890800    
 C  -0.6288000      0.3949000       1.576100    
 C    2.482500      0.2967000      0.2268000    
 C   -2.060100      -2.174600     -0.1172000    
 C   -3.091400      -1.522600      0.7136000    
 C   -1.611300      -3.398900      0.1705000    
 C    4.611300     -0.6317000      0.6625000    
 C    5.649100      -1.552000      9.5100001E-02
 H   -2.502400      0.7432000      -1.357200    
 H    1.901300      0.4924000      -1.798100    
 H    1.361100       3.225900     -0.8390000    
 H    1.274300       2.563900      0.8064000    
 H   -2.432100      -1.413800      -2.003100    
 H   0.7579000      -1.668500     -3.6600001E-02
 H    1.722900      -1.761200      -1.476700    
 H  -0.8910000       4.011600     -0.7175000    
 H  -0.4319000       4.111300       1.014700    
 H  -0.2658000     -0.7587000      -2.778300    
 H  -0.2759000      -2.422600      -2.286900    
 H   -1.505300      0.3926000       2.235000    
 H  -0.2444000     -0.6253000       1.546100    
 H   0.1188000       1.015400       2.081900    
 H    2.101800     -3.9099999E-02   1.196300    
 H    2.893300       1.305200      0.3300000    
 H  -0.9029000       2.227400      -2.044100    
 H  -0.8533000      -3.877400     -0.4395000    
 H   -1.986900      -3.959500       1.020000    
 H    6.006700      -1.161700     -0.8610000    
 H    5.227200      -2.552200     -3.0800000E-02
 H    6.495400      -1.614500      0.7851000    


%chk=000174868-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174868

0 1
O -0.172760 1.584777 -2.102334
O -3.162572 -0.261532 0.421887
O -2.845746 2.697492 0.555546
O 3.562269 -0.593829 -0.208358
O -3.723994 -2.123925 1.703805
O 4.799668 0.072578 1.649429
C -1.033167 0.998691 0.160360
C 0.256375 1.331698 -0.685776
C -2.093962 0.108312 -0.572434
C 1.382423 0.260172 -0.855612
C 0.751796 2.688596 -0.085751
C -1.693046 -1.268423 -1.209998
C -1.640604 2.433444 0.358488
C 0.903565 -1.212327 -0.973549
C -0.528518 3.490344 0.231929
C -0.318556 -1.430488 -1.889889
C -0.702536 0.479865 1.591631
C 2.496090 0.365702 0.204551
C -2.024496 -2.264718 -0.107560
C -3.043324 -1.626225 0.789235
C -1.588163 -3.532602 0.087407
C 4.690038 -0.636404 0.624347
C 5.698772 -1.633960 0.099204
H -2.610342 0.733638 -1.317075
H 1.845695 0.532906 -1.825598
H 1.422062 3.193676 -0.802282
H 1.319576 2.525277 0.845151
H -2.457824 -1.431934 -2.001291
H 0.696952 -1.631937 0.030506
H 1.759719 -1.789436 -1.364524
H -0.812028 4.208290 -0.561768
H -0.462467 4.081969 1.162238
H -0.262961 -0.745993 -2.754517
H -0.283891 -2.460526 -2.297557
H -1.620723 0.468282 2.200880
H -0.293089 -0.544026 1.568273
H 0.032359 1.128855 2.099001
H 2.157302 0.090413 1.220051
H 2.956268 1.366884 0.247928
H -0.791022 2.360821 -2.128627
H -0.850129 -4.006225 -0.569137
H -1.980284 -4.120450 0.925497
H 6.017253 -1.352650 -0.919521
H 5.244859 -2.638071 0.035892
H 6.571863 -1.662502 0.766522


