%chk=000145473.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145473

0 1
 O   0.1980000      -2.242300       1.371400    
 O   0.5379000       1.282100       2.022900    
 O   -2.289900     -0.2388000       2.114400    
 O    5.741900     -0.5920000      -1.110600    
 C  -0.5647000     -0.1558000      0.4294000    
 C   0.4849000      -1.236100      0.7239000    
 C  -0.1419000       1.238200      0.9743000    
 C   -1.939200     -0.5601000      0.9797000    
 C    1.886500      -1.063800      0.2350000    
 C  -0.5377000       2.462000      0.2961000    
 C   -2.867600      -1.372900      0.1367000    
 C    2.096300     -0.3513000     -0.9223000    
 C    2.910000      -1.625200      0.9623000    
 C   -1.735000       2.507500     -0.4183000    
 C   -2.329400      -2.245600     -0.7798000    
 C   0.2794000       3.590800      0.3603000    
 C   -4.222600      -1.215400      0.3121000    
 C    3.404600     -0.1909000      -1.378700    
 C    4.218300      -1.464800      0.5059000    
 C    4.465700     -0.7475000     -0.6646000    
 C   -2.115100       3.681500      -1.068600    
 C   -3.195900      -3.004300      -1.566500    
 C  -0.1009000       4.764800     -0.2901000    
 C   -5.089100      -1.974500     -0.4746000    
 C   -1.298100       4.810100      -1.004400    
 C   -4.575600      -2.868900      -1.413900    
 C    6.779100      -1.187000     -0.3322000    
 H  -0.6627000     -7.0799999E-02 -0.6588000    
 H    1.295000      8.0399998E-02  -1.510400    
 H    2.730900      -2.180900       1.877700    
 H   -2.400900       1.654100     -0.4848000    
 H   -1.264600      -2.381000     -0.9247000    
 H    1.218100       3.573000      0.9079000    
 H   -4.634800     -0.5186000       1.035300    
 H    3.591000      0.3657000      -2.293200    
 H    4.994900      -1.922100       1.109500    
 H   -3.048100       3.717800      -1.623400    
 H   -2.796600      -3.701400      -2.297500    
 H   0.5357000       5.643500     -0.2413000    
 H   -6.163600      -1.868100     -0.3571000    
 H   -1.594200       5.724200      -1.510600    
 H   -5.250300      -3.459700      -2.026500    
 H    6.683100      -2.277600     -0.3003000    
 H    6.834600     -0.7456000      0.6688000    
 H    7.727200     -0.9641000     -0.8326000    


%chk=000145473-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000145473

0 1
O 0.080176 -1.620001 1.890400
O 0.600069 1.780184 1.944727
O -2.585436 0.524177 1.718680
O 5.747696 -1.130705 -1.176832
C -0.532398 0.237230 0.425203
C 0.454769 -0.826120 0.981823
C -0.165844 1.650081 0.952143
C -1.989094 -0.126312 0.818578
C 1.828627 -0.884801 0.404599
C -0.730235 2.844005 0.238274
C -2.663234 -1.250780 0.087963
C 2.292766 -0.010868 -0.620690
C 2.722813 -1.866187 0.909627
C -1.612137 2.740325 -0.870988
C -2.021377 -2.013197 -0.924641
C -0.354443 4.133788 0.704026
C -4.008683 -1.553734 0.433467
C 3.596595 -0.119091 -1.124508
C 4.033245 -1.988569 0.417229
C 4.473950 -1.109485 -0.608732
C -2.104754 3.901965 -1.501864
C -2.713188 -3.052809 -1.580926
C -0.844730 5.292970 0.073334
C -4.699180 -2.590912 -0.221989
C -1.721105 5.180226 -1.033599
C -4.053216 -3.342738 -1.233637
C 6.712278 -2.115540 -0.670132
H -0.458534 0.245429 -0.679074
H 1.643921 0.773766 -1.024688
H 2.360204 -2.527072 1.703876
H -1.934946 1.760873 -1.240835
H -0.978354 -1.817691 -1.196760
H 0.319119 4.193816 1.565193
H -4.483290 -0.961038 1.222364
H 3.966063 0.549799 -1.907112
H 4.696998 -2.753403 0.830882
H -2.788958 3.812837 -2.352485
H -2.209352 -3.639370 -2.356664
H -0.550439 6.282037 0.440640
H -5.735039 -2.817815 0.052436
H -2.104949 6.081469 -1.524633
H -4.588822 -4.151095 -1.744002
H 6.353168 -3.148997 -0.836061
H 6.915713 -1.956757 0.405778
H 7.628172 -1.941294 -1.252591


