%chk=000082340.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082340

0 1
 O   -1.037000      -1.687700     -0.6032000    
 O    1.052300      -1.701000      0.5936000    
 C  -1.9999999E-04  -2.478100      3.9999999E-04
 C   -2.403000      0.2782000     -0.5476000    
 C    2.417400      0.2658000      0.5453000    
 C   -1.722300     -0.8063000      0.2755000    
 C    1.715000     -0.8005000     -0.2832000    
 C   -3.174600       1.255900      0.3358000    
 C    3.166200       1.262700     -0.3364000    
 C   0.5479000      -3.393300      -1.103200    
 C  -0.5663000      -3.367600       1.115700    
 C   -3.889500       2.316400     -0.5010000    
 C    3.903000       2.304800      0.5044000    
 C   -4.686500       3.271800      0.3729000    
 C    4.677600       3.279000     -0.3690000    
 H   -1.649300      0.8138000      -1.138300    
 H   -3.077400     -0.1903000      -1.275400    
 H    1.679500      0.7884000       1.166900    
 H    3.110200     -0.2183000       1.244900    
 H   -1.028000     -0.3419000      0.9845000    
 H   -2.471000      -1.374500      0.8380000    
 H    1.004700     -0.3201000     -0.9650000    
 H    2.447900      -1.357100     -0.8770000    
 H   -2.485500       1.742200       1.036900    
 H   -3.910400      0.7059000      0.9353000    
 H    2.459300       1.764100      -1.008600    
 H    3.885800      0.7259000     -0.9666000    
 H   0.8839000      -2.809300      -1.967400    
 H    1.402900      -3.978700     -0.7491000    
 H  -0.2269000      -4.074100      -1.473200    
 H  -0.8844000      -2.767800       1.975900    
 H   -1.435700      -3.937000      0.7708000    
 H   0.1936000      -4.062500       1.490300    
 H   -4.567600       1.833800      -1.214500    
 H   -3.156800       2.886400      -1.084100    
 H    4.599100       1.806900       1.189500    
 H    3.186000       2.861900       1.118600    
 H   -5.451400       2.735900      0.9440000    
 H   -4.033500       3.794700       1.078900    
 H   -5.188100       4.022400     -0.2458000    
 H    5.427200       2.755700     -0.9712000    
 H    4.006800       3.817000      -1.046400    
 H    5.195500       4.016000      0.2526000    


%chk=000082340-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000082340

0 1
O -1.056058 -1.662143 -0.599138
O 1.049662 -1.663718 0.599557
C -0.003605 -2.504797 -0.000168
C -2.523474 0.262664 -0.523781
C 2.519756 0.259099 0.525935
C -1.768038 -0.761911 0.329914
C 1.762550 -0.763383 -0.328694
C -3.350591 1.250059 0.331161
C 3.347558 1.246613 -0.328197
C 0.507129 -3.352028 -1.174912
C -0.515194 -3.352583 1.173803
C -4.131802 2.274737 -0.523389
C 4.130850 2.268979 0.527213
C -4.957548 3.262826 0.328234
C 4.957091 3.257295 -0.323663
H -1.794571 0.818136 -1.146203
H -3.190095 -0.278933 -1.223037
H 1.791915 0.814634 1.149538
H 3.186129 -0.284264 1.224059
H -1.038285 -0.265717 1.001873
H -2.479419 -1.346046 0.951486
H 1.033220 -0.265363 -0.999771
H 2.472864 -1.347746 -0.951265
H -2.679923 1.794164 1.028947
H -4.065977 0.684474 0.964566
H 2.677070 1.792643 -1.024659
H 4.061674 0.680986 -0.962995
H 0.758227 -2.711581 -2.036550
H 1.400683 -3.923570 -0.870702
H -0.278382 -4.056707 -1.495737
H -0.765680 -2.712668 2.036017
H -1.409318 -3.922936 0.869048
H 0.269601 -4.058344 1.494007
H -4.803185 1.730285 -1.218262
H -3.418003 2.837605 -1.158708
H 4.802186 1.722615 1.220634
H 3.418363 2.831793 1.164049
H -5.693877 2.725559 0.955614
H -4.304233 3.846053 1.004406
H -5.512265 3.978762 -0.305823
H 5.691764 2.719970 -0.952936
H 4.303875 3.842799 -0.997959
H 5.513757 3.971189 0.310988


