%chk=000108179.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108179

0 1
 O    1.048800      -3.176000     -0.2795000    
 O   -1.154200      -1.506900      -1.069500    
 O   -4.336600     -0.6178000       1.328600    
 O    3.079800     -0.7443000      6.8999999E-03
 O   0.6212000     -0.3071000      -1.920200    
 O   -1.758300       1.156000      0.9773000    
 O    3.735800      -2.925000     -0.3818000    
 O   -1.107700       4.079200      -2.533500    
 C   0.9128000      -1.765900     -5.0099999E-02
 C  -1.6100001E-02  -2.752200      0.5768000    
 C   -1.355300      -2.508100     -3.9500002E-02
 C   -3.613600      -1.465900      0.4244000    
 C   -2.337300      -1.980900       1.011700    
 C    1.969600      -1.131600      0.8076000    
 C   -3.895100     -7.3000002E-03  0.1073000    
 C   0.1484000      -1.088800      -1.111400    
 C    1.415800      6.3400000E-02   1.614800    
 C   -4.492000      -2.487900     -0.2154000    
 C    1.487700       1.443000      0.9137000    
 C   -2.742000       1.023000      4.2900000E-02
 C   0.3220000       2.365100       1.334200    
 C  -0.8970000       2.105800      0.5182000    
 C   -2.543600       1.920900     -0.9840000    
 C    2.795500       2.120700       1.214300    
 C   -1.354400       2.622700     -0.6754000    
 C    3.677700      -1.746500     -0.7057000    
 C    3.667000       2.429900      3.3300001E-02
 C    3.161700       2.431300       2.466600    
 C  -0.7068000       3.644400      -1.444400    
 C    4.266100      -1.193200      -1.968100    
 H   2.1700000E-02  -2.998600       1.624900    
 H   -1.736200      -3.414600     -0.5211000    
 H   -2.561700      -2.785200       1.724900    
 H   -1.855500      -1.200500       1.610400    
 H    2.325700      -1.866800       1.543200    
 H   -4.678000      0.1959000     -0.6180000    
 H    1.967200      9.2500001E-02   2.563100    
 H   0.3837000     -0.1637000       1.906700    
 H   -5.492100      -2.096000     -0.4320000    
 H   -4.060500      -2.826400      -1.162700    
 H   -4.616200      -3.359500      0.4359000    
 H    1.422900       1.296900     -0.1700000    
 H   0.5951000       3.421400       1.213200    
 H   8.5900001E-02   2.233000       2.398000    
 H   -3.169800       2.038600      -1.857600    
 H    3.964900       1.523300     -0.4960000    
 H    3.133000       3.079500     -0.6685000    
 H    4.583600       2.951800      0.3289000    
 H    4.109600       2.919600       2.668400    
 H    2.528100       2.219900       3.321200    
 H   0.2226000       4.056200      -1.016700    
 H    5.097500     -0.5267000      -1.726800    
 H    3.498400     -0.6610000      -2.535500    
 H    4.639800      -2.015900      -2.584400    


%chk=000108179-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108179

0 1
O 0.761319 -3.520542 -0.457616
O -1.383539 -1.821047 -1.236922
O -4.478910 -0.449444 1.329849
O 2.966377 -1.175502 -0.337274
O 0.307322 -0.423546 -1.999681
O -1.632842 0.931712 0.764078
O 4.514713 -1.746862 1.314374
O -1.806000 5.002056 -1.545542
C 0.712091 -2.029469 -0.116723
C -0.248247 -2.986475 0.517605
C -1.632337 -2.731640 -0.066420
C -3.800954 -1.416408 0.372240
C -2.534494 -2.026651 0.964435
C 1.878571 -1.440182 0.640401
C -3.883152 0.043300 0.004077
C -0.063419 -1.307371 -1.215585
C 1.497070 -0.161272 1.435089
C -4.744377 -2.378288 -0.333275
C 1.542971 1.167563 0.630946
C -2.841990 1.078813 0.009414
C 0.478623 2.188321 1.204630
C -0.868623 2.096005 0.559051
C -2.818921 2.298631 -0.634317
C 2.917439 1.855767 0.582702
C -1.569714 2.952234 -0.299780
C 4.275502 -1.363567 0.148805
C 3.156650 2.660515 -0.683634
C 3.840853 1.802967 1.578756
C -1.129086 4.267531 -0.773179
C 5.283980 -1.019674 -0.919101
H -0.141876 -3.338780 1.548685
H -2.093887 -3.639072 -0.490276
H -2.837407 -2.780686 1.718958
H -1.964986 -1.241414 1.488169
H 2.248113 -2.208605 1.346926
H -4.663847 0.292744 -0.728396
H 2.162649 -0.092654 2.312475
H 0.474305 -0.312812 1.830493
H -5.701815 -1.880960 -0.561186
H -4.305300 -2.731781 -1.283964
H -4.960962 -3.255842 0.303222
H 1.261521 0.958386 -0.417014
H 0.842877 3.219559 1.054530
H 0.398074 2.044990 2.299632
H -3.587437 2.715211 -1.281955
H 3.173157 1.990148 -1.565249
H 2.339396 3.387421 -0.864903
H 4.106556 3.220398 -0.647330
H 4.786420 2.352052 1.500432
H 3.707821 1.213670 2.492041
H -0.128026 4.604063 -0.403742
H 5.407013 0.078399 -0.954772
H 4.935759 -1.352470 -1.909485
H 6.254604 -1.475739 -0.675093


