%chk=000152262.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152262

0 1
 O    3.486600     -0.1089000       1.600300    
 O    1.933800       2.806200      -1.134900    
 O    3.544800      -1.860700      -1.490600    
 O    2.154400       2.565300       1.106800    
 O    3.353600      -2.483400      0.6699000    
 O    6.568900     -0.6259000      -1.268200    
 O    6.445600     -0.5622000       1.001900    
 C    2.097700      0.5638000     -0.2922000    
 C   0.8337000     -9.4400004E-02  0.3179000    
 C    3.437500     -9.0200000E-02  0.1617000    
 C  -0.4689000      0.4815000     -0.2586000    
 C   -1.731600     -0.1266000      0.3630000    
 C   -3.063600      0.3405000     -0.2339000    
 C   -4.286000     -0.3460000      0.3805000    
 C   -5.581300      0.1484000     -0.2680000    
 C    4.748600      0.5578000     -0.3175000    
 C   -6.839900     -0.4890000      0.3280000    
 C    2.068100       2.063100     -6.6000000E-03
 C    3.443100      -1.590100     -0.1652000    
 C   -8.133600     -1.3200000E-02 -0.3381000    
 C   -9.357700     -0.6848000      0.2854000    
 C    5.994000     -0.2656000     -9.5399998E-02
 C   -10.64760     -0.1856000     -0.3460000    
 H    2.034000      0.4424000      -1.383100    
 H   0.8450000      -1.174200      0.1320000    
 H   0.8306000      4.5100000E-02   1.406000    
 H  -0.5069000       1.566100     -0.1066000    
 H  -0.4856000      0.3116000      -1.342100    
 H   -1.732900      8.7700002E-02   1.439200    
 H   -1.673900      -1.218400      0.2663000    
 H   -3.149600       1.426200     -0.1023000    
 H   -3.051000      0.1535000      -1.314900    
 H   -4.314300     -0.1477000       1.458600    
 H   -4.202400      -1.431700      0.2526000    
 H   -5.648500       1.238100     -0.1598000    
 H   -5.548900     -6.1500002E-02  -1.344400    
 H    4.915800       1.517600      0.1866000    
 H    4.669700      0.7798000      -1.389500    
 H   -6.880700     -0.2649000       1.401200    
 H   -6.766300      -1.579700      0.2348000    
 H   -8.097500     -0.2355000      -1.411500    
 H   -8.216600       1.075500     -0.2358000    
 H    4.338200     -0.4845000       1.881000    
 H   -9.290900      -1.771700      0.1594000    
 H   -9.385100     -0.4837000       1.362700    
 H    1.915600       3.767300     -0.9395000    
 H   -10.76050      0.8943000     -0.2068000    
 H   -11.51010     -0.6791000      0.1130000    
 H   -10.66640     -0.3979000      -1.419800    
 H    3.539900      -2.825300      -1.668700    
 H    7.383100      -1.155200      -1.130000    


%chk=000152262-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152262

0 1
O 3.662505 0.264167 1.541787
O 3.070271 2.823369 -0.699385
O 3.033732 -2.013609 -1.294605
O 1.530650 2.663904 1.020029
O 3.280115 -2.464298 0.973583
O 6.972898 -0.129050 -1.198275
O 6.189965 -0.734630 0.894012
C 2.115880 0.617972 -0.276461
C 0.850404 -0.030764 0.336942
C 3.446443 -0.105075 0.156653
C -0.466873 0.510159 -0.263240
C -1.710932 -0.201745 0.314246
C -3.038954 0.331625 -0.267955
C -4.286518 -0.381406 0.300437
C -5.615056 0.157508 -0.276278
C 4.651446 0.302573 -0.747578
C -6.863419 -0.559955 0.285315
C 2.181098 2.096402 0.123636
C 3.246344 -1.639906 0.043961
C -8.192216 -0.017474 -0.287641
C -9.440506 -0.738753 0.270468
C 5.967663 -0.244229 -0.242168
C -10.763498 -0.189171 -0.305750
H 2.066574 0.570083 -1.381429
H 0.884701 -1.123622 0.164087
H 0.866198 0.127331 1.429904
H -0.548639 1.595828 -0.063987
H -0.452714 0.381686 -1.366703
H -1.719027 -0.080672 1.417033
H -1.637709 -1.292830 0.120853
H -3.114694 1.420244 -0.064755
H -3.026514 0.221788 -1.372923
H -4.296909 -0.274897 1.405349
H -4.212866 -1.470037 0.094500
H -5.691165 1.244726 -0.064548
H -5.602080 0.057208 -1.382058
H 4.717266 1.406120 -0.767619
H 4.496238 -0.026788 -1.788605
H -6.874879 -0.462709 1.391259
H -6.788995 -1.646847 0.070548
H -8.180972 -0.111255 -1.394008
H -8.269981 1.068467 -0.069545
H 4.461509 -0.233822 1.874018
H -9.362408 -1.823411 0.051070
H -9.450249 -0.645911 1.375823
H 3.074443 3.773801 -0.400754
H -10.880040 0.886339 -0.073249
H -11.639610 -0.721354 0.108747
H -10.791519 -0.298010 -1.406604
H 2.904744 -2.999292 -1.347883
H 7.831857 -0.465578 -0.821456


