%chk=000129296.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129296

0 1
 O   0.7223000      0.2499000      -1.189200    
 O    1.163100      -2.525900     -0.5610000    
 O   -3.076400      -2.614800       1.614600    
 O    3.933200       3.137400      0.8197000    
 O    3.338700      -2.789600      -1.216900    
 O    1.429800       3.831600      0.2407000    
 C   -2.356900     -0.5675000      0.5912000    
 C   -1.388900      0.1455000     -0.1183000    
 C  -0.1915000     -0.4763000     -0.4739000    
 C   1.7999999E-02  -1.808800     -0.1398000    
 C   -3.639000      9.2900001E-02  0.9886000    
 C    1.928000      0.3853000     -0.5494000    
 C    2.773900     -0.6971000     -0.3080000    
 C   -2.136300      -1.904100      0.9301000    
 C  -0.9494000      -2.533100      0.5565000    
 C    4.008500     -0.4804000      0.3161000    
 C   -1.643300       1.569300     -0.4992000    
 C    2.313800       1.678600     -0.1850000    
 C    2.463300      -2.066400     -0.7566000    
 C   -4.718800     -5.3700000E-02 -5.2900001E-02
 C    4.384200      0.8084000      0.6988000    
 C    3.538800       1.887200      0.4462000    
 C    4.960500      -1.589700      0.6360000    
 C   -5.713800      0.8061000     -0.3435000    
 C    1.451700       2.822400     -0.4646000    
 C   -6.761500      0.5959000      -1.399700    
 C   -5.852200       2.096800      0.4194000    
 H   -4.006700     -0.3223000       1.935500    
 H   -3.445800       1.140600       1.240400    
 H  -0.7834000      -3.579000      0.7998000    
 H   -1.135400       1.827200      -1.432700    
 H   -2.694800       1.773400     -0.7172000    
 H   -1.309500       2.242500      0.2957000    
 H   -4.694800     -0.9812000     -0.6252000    
 H    5.338100      0.9853000       1.190400    
 H    4.442900      -2.440800       1.091000    
 H    5.495800      -1.911100     -0.2630000    
 H    5.715000      -1.273000       1.365800    
 H   -3.961400      -2.252400       1.452500    
 H   0.8153000       2.758600      -1.359600    
 H   -6.608300     -0.3457000      -1.937100    
 H   -7.758900      0.5658000     -0.9497000    
 H   -6.731300       1.408100      -2.133100    
 H   -5.300200       2.121900       1.361600    
 H   -5.519200       2.935800     -0.2001000    
 H   -6.903000       2.264900      0.6818000    
 H    3.307900       3.808500      0.5051000    


%chk=000129296-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129296

0 1
O 1.165313 0.522870 -1.371469
O 1.008385 -2.314806 -0.799546
O -3.511738 -1.874188 0.674511
O 4.730995 2.929254 0.876089
O 3.154739 -3.013738 -0.738872
O 3.077740 4.107708 -0.640680
C -2.390055 0.154548 -0.190633
C -1.200299 0.742782 -0.712774
C -0.041078 -0.063398 -0.841002
C -0.065842 -1.434744 -0.514603
C -3.654085 0.971278 0.080640
C 2.303242 0.482994 -0.529003
C 2.818346 -0.730155 -0.014354
C -2.385689 -1.233732 0.144773
C -1.236187 -2.029748 -0.024126
C 3.963241 -0.677882 0.872805
C -1.155349 2.198056 -1.147331
C 2.939947 1.737388 -0.281086
C 2.376175 -2.064938 -0.524067
C -4.926429 0.344167 -0.483173
C 4.553891 0.558319 1.179281
C 4.088508 1.757381 0.592770
C 4.545506 -1.928757 1.499392
C -6.153635 0.253234 0.118629
C 2.497206 2.982597 -0.884805
C -7.334045 -0.353559 -0.621808
C -6.464359 0.740456 1.523135
H -3.754905 1.121380 1.173962
H -3.541766 1.982493 -0.349517
H -1.260596 -3.096722 0.206765
H -0.300889 2.372192 -1.816488
H -2.068797 2.481987 -1.697469
H -1.060839 2.884289 -0.283972
H -4.835809 -0.017556 -1.518786
H 5.406991 0.614725 1.860427
H 3.761073 -2.583813 1.917592
H 5.074280 -2.533300 0.742509
H 5.250614 -1.663151 2.303488
H -4.331894 -1.323335 0.499257
H 1.649535 2.952811 -1.588965
H -7.057014 -0.692806 -1.634388
H -7.749487 -1.218010 -0.067883
H -8.155804 0.383055 -0.718631
H -5.575625 1.078491 2.079655
H -7.176753 1.587833 1.480776
H -6.958261 -0.055677 2.112941
H 4.243603 3.688731 0.357834


