%chk=000102954.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102954

0 1
 O    3.076700     -0.9657000      0.4701000    
 O    2.863400       1.261600      0.8877000    
 C   -1.680300      0.9658000      0.1124000    
 C   0.4610000      5.4800000E-02 -0.9984000    
 C  -0.1722000       1.173700     -0.1568000    
 C   -1.921600     -0.4455000      0.6955000    
 C   -1.296000      -1.571100     -0.1428000    
 C   0.2001000      -1.318600     -0.3671000    
 C   -2.152600       2.015600       1.137100    
 C   -2.497000       1.168800      -1.178500    
 C    1.963000      0.2922000      -1.159700    
 C   -1.514100      -2.925400      0.5330000    
 C    2.669500      0.2938000      0.1675000    
 H   1.8300001E-02  6.7900002E-02  -2.001900    
 H   0.3298000       1.237300      0.8162000    
 H  -1.0700000E-02   2.140700     -0.6508000    
 H   -2.999600     -0.6248000      0.8015000    
 H   -1.503600     -0.4901000       1.711000    
 H   -1.793700      -1.609800      -1.119500    
 H   0.6944000      -1.401700      0.6072000    
 H   0.6166000      -2.106000      -1.007600    
 H   -3.220400       1.902200       1.355900    
 H   -1.608800       1.921700       2.083800    
 H   -1.993800       3.033200      0.7627000    
 H   -2.347300       2.176900      -1.581800    
 H   -2.224400      0.4601000      -1.965300    
 H   -3.569200       1.046200     -0.9866000    
 H    2.414900     -0.4652000      -1.811400    
 H    2.155200       1.257800      -1.642600    
 H   -1.094500      -3.734200     -7.4500002E-02
 H   -1.039000      -2.961400       1.519400    
 H   -2.582800      -3.125300      0.6645000    
 H    3.540500      -1.002500       1.333600    


%chk=000102954-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000102954

0 1
O 3.644665 -0.941625 0.117264
O 2.779781 0.950315 1.139398
C -1.739854 0.990592 0.101313
C 0.465856 0.065002 -0.914893
C -0.206911 1.195104 -0.097136
C -1.989868 -0.430968 0.690878
C -1.334972 -1.582194 -0.114342
C 0.182300 -1.316400 -0.275489
C -2.257801 2.052229 1.105606
C -2.503485 1.171025 -1.239359
C 1.994801 0.309442 -1.128396
C -1.594332 -2.948165 0.558077
C 2.806093 0.188657 0.145471
H 0.029642 0.064055 -1.935896
H 0.279631 1.255364 0.896308
H -0.029814 2.171886 -0.593038
H -3.082313 -0.606695 0.773332
H -1.584320 -0.459345 1.725475
H -1.789688 -1.609037 -1.127871
H 0.655695 -1.359281 0.729066
H 0.647857 -2.119887 -0.880906
H -3.344083 1.934136 1.282947
H -1.741129 1.962193 2.079890
H -2.086188 3.077277 0.724776
H -2.330355 2.183209 -1.652210
H -2.195182 0.438756 -2.006910
H -3.592712 1.050998 -1.084650
H 2.390132 -0.409995 -1.864759
H 2.138899 1.333858 -1.521147
H -1.140834 -3.774976 -0.020535
H -1.160613 -2.971302 1.576626
H -2.677930 -3.151177 0.649200
H 4.148830 -0.990052 0.975713


