%chk=000176991.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176991

0 1
 O   -2.136500       1.788500      0.8033000    
 O   -1.951800      -3.011100     -0.1162000    
 O   -4.527500       1.203500      0.8891000    
 O    6.546000      0.1893000     -0.3948000    
 C   -2.201900     -0.5864000      0.2579000    
 C   -1.487500      0.7768000      1.7600000E-02
 C   2.3000000E-02  0.7759000      0.3905000    
 C   0.8176000     -0.4242000     -0.1830000    
 C   -3.538200     -0.4428000     -0.5530000    
 C   -1.361600      -1.736700     -0.3807000    
 C    2.328400     -0.4296000      0.3010000    
 C   -1.802100       1.067400      -1.458100    
 C   9.0599999E-02  -1.752500      9.3599997E-02
 C   -3.244700      0.6012000      -1.651000    
 C   0.7057000       2.102400     -6.3000000E-03
 C   -2.443900     -0.8613000       1.758000    
 C    2.939400      0.9734000      0.2292000    
 C    3.133900      -1.381400     -0.6354000    
 C   -4.782500     -3.4499999E-02  0.2396000    
 C    2.196600       2.082100      8.2900003E-02
 C    2.453400     -0.9256000       1.762700    
 C    4.443700       1.081900      0.3265000    
 C    4.650700      -1.296100     -0.4693000    
 C    5.144900      0.1363000     -0.6432000    
 C   -5.995900      0.1037000     -0.6610000    
 H   7.3100001E-02  0.7200000       1.487200    
 H   0.8333000     -0.2964000      -1.275900    
 H   -3.775200      -1.399100      -1.038100    
 H   -1.358200      -1.640600      -1.472500    
 H   -1.143000      0.5183000      -2.138000    
 H   -1.724400       2.131100      -1.707900    
 H   0.6046000      -2.581100     -0.4075000    
 H   0.1152000      -2.003200       1.158800    
 H   -3.895700       1.478700      -1.627900    
 H   -3.363400      0.1565000      -2.646100    
 H   0.3362000       2.905200      0.6427000    
 H   0.4527000       2.382700      -1.034300    
 H   -2.949300     -4.1499998E-02   2.274800    
 H   -3.050900      -1.760900       1.905900    
 H   -1.502200      -1.013000       2.294600    
 H    2.898000      -1.150700      -1.683300    
 H    2.832100      -2.422900     -0.4741000    
 H   -5.005200     -0.7804000       1.009200    
 H    2.686300       3.051000      2.0199999E-02
 H   -1.850500       2.659100      0.4803000    
 H    1.811300     -0.3542000       2.441100    
 H    2.185700      -1.983300       1.855200    
 H    3.475000     -0.8387000       2.147700    
 H    4.789100       2.105600      0.1312000    
 H    4.760200      0.8713000       1.356000    
 H    4.953300      -1.688600      0.5093000    
 H    5.142300      -1.943900      -1.205600    
 H   -1.775900      -3.243400      0.8110000    
 H    4.979700      0.4652000      -1.675900    
 H   -6.175400     -0.8113000      -1.234100    
 H   -6.884600      0.2953000     -4.8099998E-02
 H   -5.934000      0.9478000      -1.353500    
 H   -4.631700       1.929100      0.2524000    
 H    6.703000     -0.1171000      0.5146000    


%chk=000176991-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000176991

0 1
O -2.155048 1.851130 0.835612
O -2.033593 -2.973149 -0.262282
O -4.851991 1.383257 0.691012
O 6.671086 0.134437 -0.404171
C -2.229692 -0.511960 0.238222
C -1.465311 0.830234 -0.027243
C 0.044530 0.833843 0.358534
C 0.831041 -0.378649 -0.217153
C -3.571953 -0.375383 -0.590218
C -1.389293 -1.656819 -0.435487
C 2.322232 -0.428345 0.301765
C -1.797127 1.149752 -1.508614
C 0.072016 -1.704845 0.040832
C -3.261945 0.671441 -1.716220
C 0.730358 2.160256 -0.056295
C -2.428874 -0.803492 1.742980
C 2.964019 0.970961 0.238605
C 3.132451 -1.385791 -0.640888
C -4.855115 -0.005966 0.212416
C 2.237128 2.107584 0.070299
C 2.401315 -0.946686 1.772252
C 4.481174 1.040175 0.381968
C 4.661330 -1.357356 -0.414213
C 5.208218 0.071925 -0.580714
C -6.131361 -0.178614 -0.625480
H 0.076040 0.770876 1.466059
H 0.895681 -0.235048 -1.319097
H -3.773748 -1.373714 -1.023377
H -1.418254 -1.522924 -1.532192
H -1.096448 0.614994 -2.177337
H -1.683826 2.227577 -1.729991
H 0.568225 -2.544641 -0.478725
H 0.084676 -1.943995 1.122223
H -3.954625 1.524798 -1.607468
H -3.406683 0.248777 -2.725143
H 0.352696 2.999914 0.565228
H 0.469700 2.413668 -1.105704
H -2.975716 0.016347 2.234214
H -3.018818 -1.726820 1.895596
H -1.466273 -0.916032 2.274164
H 2.929990 -1.094108 -1.692439
H 2.763504 -2.421616 -0.519420
H -4.923029 -0.691630 1.086324
H 2.766000 3.070445 0.014318
H -1.818855 2.749764 0.592433
H 1.693681 -0.402350 2.423218
H 2.174408 -2.026510 1.835816
H 3.409345 -0.801136 2.196723
H 4.837991 2.070798 0.206379
H 4.782557 0.768925 1.418206
H 4.908524 -1.726024 0.603592
H 5.165849 -2.030496 -1.131993
H -1.995825 -3.213805 0.698779
H 5.065492 0.405825 -1.624340
H -6.280389 -1.237276 -0.907774
H -7.003564 0.157085 -0.038021
H -6.088447 0.432001 -1.545158
H -3.901338 1.653323 0.873236
H 6.887185 -0.168133 0.515452


