%chk=000072185.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072185

0 1
 O    2.987700       1.975500      0.3408000    
 O    2.336200      -3.491800      5.7000000E-02
 C   -1.041200      1.5200000E-02 -0.5794000    
 C  -0.2358000       1.341000     -0.8842000    
 C   -2.280800      0.1396000      0.3875000    
 C   9.2900001E-02   2.061500      0.4729000    
 C   -1.808800      0.8681000       1.666600    
 C   -1.132700       2.206300       1.386500    
 C   -1.424900     -0.8184000      -1.820300    
 C    1.113500      0.9480000      -1.555100    
 C   -2.806300      -1.277500      0.7114000    
 C  -0.9481000       2.282200      -1.876400    
 C   -3.489000      0.8939000     -0.2167000    
 C   -1.855200      -2.231700      -1.420100    
 C   0.7560000       3.439900      0.3256000    
 C   -2.602200      -2.312700     -0.1253000    
 C    1.914600      7.3600002E-02 -0.6479000    
 C   -3.596100      -1.492100       1.977600    
 C    2.816900      0.6260000      0.2610000    
 C    1.753400      -1.310400     -0.7169000    
 C    2.494700      -2.141600      0.1229000    
 C    3.558100     -0.2052000       1.100800    
 C    3.397100      -1.589100       1.031700    
 H  -0.3771000     -0.6120000      2.2000000E-02
 H   0.7410000       1.434800       1.084800    
 H   -1.106700      0.2304000       2.221300    
 H   -2.654800       1.051600       2.341300    
 H   -1.852300       2.913600      0.9601000    
 H  -0.8207000       2.640500       2.345700    
 H  -0.6181000     -0.9038000      -2.550900    
 H   -2.246700     -0.3365000      -2.361300    
 H    1.700100       1.833200      -1.829600    
 H   0.9565000      0.4467000      -2.517200    
 H   -1.333300       1.743200      -2.746900    
 H   -1.771500       2.832700      -1.422200    
 H  -0.2598000       3.043500      -2.263100    
 H   -3.867500      0.4172000      -1.126600    
 H   -4.327700      0.9239000      0.4898000    
 H   -3.274300       1.933400     -0.4547000    
 H  -0.9701000      -2.872700      -1.334000    
 H   -2.470900      -2.657500      -2.220900    
 H    1.483900       3.509700     -0.4839000    
 H   9.9999997E-05   4.205400      0.1112000    
 H    1.241700       3.735200       1.262400    
 H   -2.990000      -3.295500      0.1323000    
 H   -4.013500      -2.503400       2.035900    
 H   -4.436700     -0.7949000       2.038400    
 H   -2.960100      -1.354600       2.857500    
 H    1.102800      -1.761000      -1.456700    
 H    4.264400      0.2117000       1.813600    
 H    3.976900      -2.231500       1.688800    
 H    3.646400       2.172100       1.028600    
 H    1.666800      -3.699000     -0.6176000    


%chk=000072185-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072185

0 1
O 3.396231 1.931860 0.085276
O 2.598913 -3.646216 0.109151
C -1.121214 0.033481 -0.496416
C -0.276994 1.343220 -0.774058
C -2.426098 0.181682 0.385688
C -0.043603 2.117521 0.581196
C -2.018901 0.898910 1.705697
C -1.329085 2.247568 1.435515
C -1.452964 -0.800362 -1.762212
C 1.137856 0.947775 -1.389664
C -2.971602 -1.238151 0.686702
C -0.938131 2.256356 -1.845923
C -3.601304 0.964892 -0.283855
C -1.850310 -2.244781 -1.375787
C 0.587039 3.521158 0.409727
C -2.710476 -2.297327 -0.129300
C 2.057520 0.027655 -0.596969
C -3.860684 -1.420130 1.907845
C 3.174483 0.533735 0.124196
C 1.889297 -1.381275 -0.609012
C 2.755856 -2.243575 0.099762
C 4.049600 -0.325508 0.830385
C 3.842246 -1.718437 0.830107
H -0.458791 -0.596736 0.136668
H 0.669483 1.498039 1.167716
H -1.325842 0.244311 2.274248
H -2.910508 1.056298 2.343212
H -2.033697 2.949757 0.945602
H -1.057985 2.720753 2.400939
H -0.599178 -0.829970 -2.464720
H -2.285007 -0.330883 -2.319125
H 1.675989 1.892100 -1.580017
H 0.951593 0.492179 -2.380874
H -1.214285 1.678208 -2.746528
H -1.850310 2.752276 -1.475741
H -0.239116 3.049113 -2.168794
H -3.831543 0.576469 -1.290709
H -4.518373 0.853128 0.324183
H -3.399847 2.044862 -0.369474
H -0.937060 -2.859454 -1.203879
H -2.378549 -2.736776 -2.218255
H 1.538863 3.486713 -0.144601
H -0.106279 4.213729 -0.103463
H 0.804461 3.953293 1.405354
H -3.136945 -3.279088 0.126968
H -4.275517 -2.442783 1.941392
H -4.711631 -0.711048 1.910802
H -3.304943 -1.250745 2.849764
H 1.069104 -1.807380 -1.199347
H 4.903505 0.090989 1.381025
H 4.506860 -2.396583 1.372026
H 4.210204 2.164681 0.595879
H 1.786469 -3.908805 -0.390200


