%chk=000176726.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176726

0 1
 O    1.685700      -1.057600      0.1464000    
 O   -5.907500       2.536200      0.6910000    
 C   -1.629400      -2.848000      0.7433000    
 C   -2.587800      -2.238700     -0.2989000    
 C   -3.002400     -0.7981000      1.9400001E-02
 C   -3.966500     -0.2545000      -1.040500    
 C   -4.484000       1.164700     -0.7287000    
 C  -0.3552000      -2.019100      0.9915000    
 C   -1.288000      -4.289400      0.3510000    
 C   -5.516200       1.200600      0.4062000    
 C   0.5487000      -1.830400     -0.2227000    
 C   -5.074400       1.777700      -2.004000    
 C    2.533300     -0.8156000     -0.9674000    
 C    3.710100      3.0000001E-04 -0.5192000    
 C   -6.843200       2.589800       1.759800    
 C    4.867200     -0.6342000     -6.6799998E-02
 C    3.646500       1.393300     -0.5538000    
 C    5.897000       1.517600      0.3161000    
 C    5.960500      0.1245000      0.3507000    
 C    4.739900       2.151900     -0.1361000    
 C    7.065700       2.329100      0.7628000    
 H   -2.167700      -2.893400       1.699800    
 H   -2.128200      -2.273000      -1.294500    
 H   -3.489200      -2.862800     -0.3554000    
 H   -2.126100     -0.1424000      5.3900000E-02
 H   -3.469400     -0.7742000       1.009500    
 H   -4.819000     -0.9361000      -1.153500    
 H   -3.440600     -0.2484000      -2.004100    
 H   -3.634400       1.798500     -0.4418000    
 H  -0.6119000      -1.037900       1.408600    
 H   0.2326000      -2.501500       1.784500    
 H  -0.5994000      -4.739000       1.074000    
 H   -2.194000      -4.904900      0.3297000    
 H  -0.8289000      -4.344700     -0.6412000    
 H   -5.087900      0.7606000       1.313300    
 H   -6.400400      0.6143000      0.1268000    
 H   0.8900000      -2.799400     -0.6015000    
 H   7.3000002E-03  -1.310100      -1.020100    
 H   -5.941900       1.206500      -2.352000    
 H   -4.332700       1.791700      -2.809900    
 H   -5.393400       2.811800      -1.837800    
 H    2.875200      -1.766800      -1.394300    
 H    1.982600     -0.2810000      -1.751600    
 H   -7.750700       2.034400       1.503700    
 H   -6.401500       2.189200       2.677300    
 H   -7.111000       3.636000       1.930000    
 H    4.928000      -1.718800     -3.3500001E-02
 H    2.749800       1.898900     -0.9023000    
 H    6.857000     -0.3812000      0.6997000    
 H    4.678700       3.236500     -0.1691000    
 H    7.728200       2.531600     -8.4600002E-02
 H    6.742900       3.283600       1.192200    
 H    7.636900       1.806600       1.537700    


%chk=000176726-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176726

0 1
O 1.654304 -1.146965 0.263553
O -5.598013 2.815506 0.258763
C -1.722721 -2.895033 0.836918
C -2.639346 -2.334047 -0.286114
C -3.108149 -0.876067 -0.074823
C -4.142692 -0.431162 -1.135934
C -4.559610 1.063526 -1.075723
C -0.429706 -2.060104 1.065832
C -1.411171 -4.391884 0.586008
C -5.352013 1.369250 0.207670
C 0.496822 -1.951229 -0.150738
C -5.379217 1.460725 -2.324988
C 2.620692 -0.966745 -0.817845
C 3.761703 -0.081829 -0.343954
C -6.356421 3.206147 1.441886
C 4.862167 0.162545 -1.201649
C 3.753115 0.516054 0.938173
C 5.927547 1.597423 0.494391
C 5.928673 0.989958 -0.787575
C 4.823668 1.341534 1.347656
C 7.062329 2.507164 0.935421
H -2.298146 -2.832139 1.786147
H -2.125242 -2.415986 -1.266811
H -3.533808 -2.987769 -0.359143
H -2.239457 -0.187738 -0.111003
H -3.536704 -0.784432 0.944188
H -5.050554 -1.067419 -1.057132
H -3.720107 -0.627405 -2.143225
H -3.640708 1.685121 -1.044794
H -0.692088 -1.034446 1.386513
H 0.148884 -2.510708 1.895386
H -0.758967 -4.804034 1.378609
H -2.341864 -4.989136 0.567223
H -0.901811 -4.544901 -0.384231
H -4.784429 1.060030 1.113195
H -6.322270 0.817596 0.198791
H 0.839987 -2.953531 -0.490208
H -0.012547 -1.452516 -1.005423
H -6.278345 0.820473 -2.421086
H -4.778949 1.341031 -3.245986
H -5.710262 2.510357 -2.254230
H 3.012464 -1.957287 -1.146228
H 2.117017 -0.503554 -1.698650
H -7.359113 2.726040 1.462210
H -5.819513 2.941811 2.379120
H -6.477412 4.299862 1.388613
H 4.891607 -0.297533 -2.198348
H 2.906605 0.320600 1.601944
H 6.772972 1.165124 -1.465816
H 4.802333 1.794317 2.347215
H 6.763517 3.572380 0.885895
H 7.362880 2.302266 1.979142
H 7.952969 2.383462 0.294793


