%chk=000047167.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000047167

0 1
 O    4.321300      5.7000000E-02 -0.5705000    
 C   -2.643000     -0.3082000      0.4353000    
 C   -2.069100       1.107900      7.4699998E-02
 C   -1.593400      -1.380600     -2.6200000E-02
 C  -0.5846000      0.8147000      6.4999998E-02
 C  -0.3215000     -0.5617000      9.2000002E-03
 C   -4.073100     -0.5624000     -3.9799999E-02
 C   -2.507000       1.656300      -1.291500    
 C   -2.449000       2.125500       1.164000    
 C   -1.819000      -1.943000      -1.437500    
 C   -1.555400      -2.548500      0.9743000    
 C   0.4595000       1.733700      7.9800002E-02
 C   0.9877000      -1.029700     -3.2099999E-02
 C    1.773600       1.265000      4.6000000E-02
 C    2.036200     -0.1089000     -9.6000005E-03
 C    2.890100       2.258900      6.4300001E-02
 C    3.404500     -0.6078000     -5.1300000E-02
 C    3.742300      -1.968100      0.5459000    
 H   -2.682100     -0.3604000       1.535700    
 H   -4.754700      0.1901000      0.3701000    
 H   -4.162200     -0.5351000      -1.129600    
 H   -4.423400      -1.542700      0.2997000    
 H   -3.585000       1.848900      -1.318400    
 H   -2.265600      0.9757000      -2.112200    
 H   -2.005100       2.606100      -1.513300    
 H   -3.536500       2.236100       1.235800    
 H   -2.030600       3.116500      0.9542000    
 H   -2.076700       1.820600       2.149100    
 H   -1.006000      -2.620800      -1.725500    
 H   -1.857500      -1.159400      -2.198800    
 H   -2.750600      -2.516200      -1.495500    
 H   -2.524700      -3.056800       1.021200    
 H   -1.306500      -2.205900       1.985600    
 H  -0.8049000      -3.296400      0.6938000    
 H   0.2493000       2.798500      0.1101000    
 H    1.169900      -2.097500     -0.1010000    
 H    2.519000       3.263800      0.2991000    
 H    3.624600       2.022000      0.8410000    
 H    3.373500       2.321900     -0.9156000    
 H    3.615800      -2.743900     -0.2131000    
 H    3.114100      -2.178300       1.415800    
 H    4.781800      -1.958500      0.8876000    


%chk=000047167-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000047167

0 1
O 4.527168 0.157512 0.137993
C -2.684238 -0.301402 0.439702
C -2.089269 1.116771 0.056027
C -1.596222 -1.388345 0.057440
C -0.584556 0.835450 0.097707
C -0.310739 -0.553823 0.100305
C -4.111333 -0.581406 -0.062310
C -2.493685 1.607696 -1.365451
C -2.519514 2.189876 1.089754
C -1.785281 -1.998225 -1.362452
C -1.590908 -2.542239 1.093253
C 0.474446 1.762705 0.104077
C 1.019632 -0.996755 0.110166
C 1.830273 1.343253 0.118774
C 2.107604 -0.071915 0.122812
C 2.908335 2.410636 0.132518
C 3.510151 -0.603369 0.139998
C 3.728883 -2.120581 0.160029
H -2.717497 -0.306766 1.550794
H -4.816557 0.188388 0.303815
H -4.172191 -0.594492 -1.164405
H -4.475345 -1.559037 0.305973
H -3.584257 1.777270 -1.425105
H -2.211428 0.887658 -2.152674
H -1.989476 2.565268 -1.592963
H -3.620877 2.295276 1.103382
H -2.094653 3.180984 0.843194
H -2.186240 1.919921 2.108318
H -0.951048 -2.687785 -1.590951
H -1.802033 -1.225055 -2.149801
H -2.725793 -2.575996 -1.423928
H -2.572228 -3.053161 1.112526
H -1.378919 -2.165128 2.110319
H -0.827528 -3.303838 0.845091
H 0.262146 2.839000 0.105485
H 1.228319 -2.071525 0.114506
H 2.448772 3.415023 0.132939
H 3.567115 2.315088 1.013090
H 3.581331 2.321998 -0.737929
H 3.296543 -2.603839 -0.735740
H 3.264415 -2.585961 1.048984
H 4.812684 -2.310728 0.180538


