%chk=000097092.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097092

0 1
 O   0.9817000       2.045700      0.7736000    
 O    3.705400       1.886300      0.6113000    
 O    4.904600     -0.2838000     -0.6111000    
 O  -0.8865000      -2.813700       1.900100    
 O   -4.971000       1.550800     -0.7439000    
 O   -4.614400      0.2008000       1.625800    
 C    1.370600      -1.189200     -0.9537000    
 C   0.5308000      -2.331000      -1.471400    
 C   0.7517000     -7.6899998E-02 -0.3466000    
 C  -6.8099998E-02  -3.136600     -0.3228000    
 C  -0.7364000     -1.1700000E-02 -0.2696000    
 C   -1.491700      -1.059200      0.4081000    
 C  -0.8074000      -2.354900      0.7579000    
 C    1.548200      0.9489000      0.1871000    
 C    2.768800      -1.246600      -1.030700    
 C    2.938800      0.8795000      0.1022000    
 C    3.547600     -0.2144000     -0.5084000    
 C   -1.286200       1.021500     -0.9345000    
 C   -2.748000     -0.9993000      0.8762000    
 C   -2.674500       1.342800      -1.134800    
 C   -3.730400      0.1057000      0.7747000    
 C   -3.740600       1.005900     -0.4037000    
 C   0.7274000       1.968300       2.172800    
 C    4.024000       2.963300     -0.2666000    
 C    5.604100     -0.9123000      0.4610000    
 C   -5.648500      0.7103000      -1.653000    
 H  -0.2546000      -1.944600      -2.132800    
 H    1.138700      -2.995900      -2.097700    
 H  -0.7595000      -3.887600     -0.7213000    
 H   0.7453000      -3.673500      0.1832000    
 H    3.254000      -2.101900      -1.495300    
 H  -0.6351000       1.724400      -1.457300    
 H   -3.151600      -1.842000       1.438100    
 H   -2.835200       2.023800      -1.971100    
 H   6.1900001E-02   1.131500       2.406000    
 H   0.2403000       2.896600       2.483600    
 H    1.665200       1.864500       2.727700    
 H    4.634200       3.684500      0.2840000    
 H    3.113400       3.465200     -0.6086000    
 H    4.598900       2.603200      -1.125500    
 H    5.294700      -1.957600      0.5599000    
 H    5.430100     -0.3784000       1.400500    
 H    6.673700     -0.8838000      0.2356000    
 H   -6.617900       1.164100      -1.880200    
 H   -5.097000      0.6101000      -2.594600    
 H   -5.835000     -0.2792000      -1.220700    


%chk=000097092-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097092

0 1
O 1.025316 1.915913 0.683747
O 3.843439 1.714085 0.649631
O 5.055374 -0.648038 -0.547822
O -1.047721 -2.881400 1.834876
O -4.850683 1.651478 -1.236934
O -5.095773 -0.404903 0.744512
C 1.451327 -1.417580 -0.964475
C 0.597875 -2.551316 -1.501309
C 0.807023 -0.276295 -0.394775
C -0.046336 -3.329956 -0.328804
C -0.687381 -0.140519 -0.403754
C -1.509355 -1.192581 0.157040
C -0.843569 -2.474356 0.659555
C 1.628211 0.753332 0.148469
C 2.856504 -1.514421 -0.961450
C 3.047739 0.667924 0.122117
C 3.667497 -0.489668 -0.420737
C -1.206271 1.049757 -0.944751
C -2.888482 -1.189748 0.388302
C -2.542611 1.478339 -1.153605
C -3.965992 -0.231369 0.148741
C -3.769928 0.918485 -0.773316
C 1.134766 2.034892 2.159560
C 3.818089 2.958320 -0.160312
C 5.886710 -0.428208 0.658338
C -6.227773 1.101345 -1.286569
H -0.195658 -2.157679 -2.164423
H 1.208157 -3.247759 -2.102488
H -0.754218 -4.090179 -0.722527
H 0.716879 -3.879520 0.251565
H 3.357933 -2.387218 -1.391305
H -0.453757 1.753014 -1.317716
H -3.270059 -2.055971 0.947202
H -2.655124 2.411588 -1.720803
H 0.600231 1.197423 2.644703
H 0.648045 2.988710 2.412460
H 2.195706 2.046446 2.465874
H 4.470561 3.667109 0.372003
H 2.788869 3.352845 -0.222373
H 4.218080 2.759606 -1.171764
H 5.630265 -1.175754 1.433125
H 5.747172 0.590654 1.053242
H 6.922121 -0.581531 0.318998
H -6.806549 1.897940 -1.778080
H -6.247145 0.180213 -1.895295
H -6.595007 0.880148 -0.275174


