%chk=000094354.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094354

0 1
 O    2.185900       2.308900     -4.0399998E-02
 C   0.8215000       1.880400      7.4600004E-02
 C    1.924400      0.9185000     -0.2824000    
 C  -8.3099999E-02   2.441400     -0.9780000    
 C    2.525700      1.4000000E-03  0.7350000    
 C   0.3388000       1.966400       1.482300    
 C   -1.163800       1.447600      -1.414600    
 C    1.621900      -1.190100       1.077700    
 C    1.270800      -2.098900     -8.2599998E-02
 C   -2.159400       1.160700     -0.3248000    
 C   -2.616400     -4.1299999E-02  7.5900003E-02
 C   2.0500001E-02  -2.492300     -0.3982000    
 C   -2.235400      -1.364300     -0.5526000    
 C   -1.267900      -2.183100      0.3143000    
 C    2.436100      -2.623100     -0.8842000    
 C   -3.619700     -0.1321000       1.197900    
 H    2.003200      0.5587000      -1.299000    
 H   0.5060000       2.707800      -1.865800    
 H  -0.5396000       3.376900     -0.6310000    
 H    2.767300      0.5367000       1.660900    
 H    3.489700     -0.3558000      0.3528000    
 H    1.154800       1.966200       2.212600    
 H  -0.2147000       2.897700       1.646600    
 H  -0.3280000       1.138300       1.732600    
 H  -0.6798000      0.5363000      -1.777300    
 H   -1.709800       1.879800      -2.261800    
 H   0.7265000     -0.8173000       1.576400    
 H    2.141800      -1.800800       1.827800    
 H   -2.546900       2.046300      0.1778000    
 H  -0.1023000      -3.156100      -1.253900    
 H   -3.157400      -1.944900     -0.6952000    
 H   -1.844600      -1.225300      -1.566400    
 H   -1.741400      -3.147200      0.5433000    
 H   -1.097800      -1.712000       1.285700    
 H    2.907000      -1.819800      -1.458600    
 H    2.135800      -3.400600      -1.595000    
 H    3.185400      -3.064600     -0.2187000    
 H   -3.223600     -0.7355000       2.020500    
 H   -4.545900     -0.5949000      0.8418000    
 H   -3.877800      0.8508000       1.606400    


%chk=000094354-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000094354

0 1
O 2.336898 2.353123 -0.152572
C 0.874937 1.972014 0.120224
C 1.885363 0.907847 -0.216844
C -0.071544 2.434758 -0.992177
C 2.524440 -0.037699 0.786635
C 0.423682 2.227755 1.548662
C -1.169924 1.406935 -1.398571
C 1.651357 -1.286981 1.106684
C 1.292060 -2.150361 -0.098643
C -2.195568 1.120389 -0.318782
C -2.698989 -0.091190 0.058577
C 0.021340 -2.550414 -0.401549
C -2.287485 -1.420954 -0.564558
C -1.270838 -2.237036 0.327928
C 2.464045 -2.602966 -0.958421
C -3.728887 -0.197016 1.173337
H 1.846291 0.524384 -1.249224
H 0.547293 2.657794 -1.881938
H -0.551384 3.387055 -0.688624
H 2.726247 0.509180 1.725273
H 3.511882 -0.350056 0.394890
H 1.163399 1.875750 2.285592
H 0.277598 3.312283 1.707196
H -0.539812 1.721447 1.739621
H -0.683734 0.474506 -1.738043
H -1.690899 1.831364 -2.283802
H 0.738637 -0.951543 1.629793
H 2.221025 -1.908871 1.829977
H -2.581696 2.015473 0.197122
H -0.106140 -3.188524 -1.291487
H -3.199163 -2.030005 -0.725162
H -1.839437 -1.263025 -1.560601
H -1.743362 -3.191592 0.635517
H -1.072525 -1.677165 1.258995
H 2.967133 -1.749697 -1.454699
H 2.139622 -3.306020 -1.745044
H 3.235806 -3.107999 -0.343695
H -3.386187 -0.886757 1.970757
H -4.685423 -0.608385 0.793176
H -3.938258 0.782997 1.636879


