%chk=000001429.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001429

0 1
 O    10.18350      0.5627000     -0.3892000    
 O    8.804800       1.979400      0.7371000    
 O   -5.766400     -5.3700000E-02   1.491000    
 C    3.965000     -0.1536000      0.1388000    
 C    2.880400      -1.115500     -0.3525000    
 C    5.353400     -0.4555000     -0.4339000    
 C    1.536500     -0.8232000      0.3234000    
 C    6.500700      0.4190000      8.8399999E-02
 C   0.4042000      -1.741600     -0.1485000    
 C    7.884600      6.3900001E-02 -0.4547000    
 C  -0.9280000      -1.405100      0.4593000    
 C   -8.058100      0.7469000      8.3600000E-02
 C    8.967700      0.9943000      3.2600001E-02
 C   -6.752500      0.4458000     -0.6532000    
 C   -9.229200       1.143400     -0.8213000    
 C   -1.991300      -1.009100     -0.2564000    
 C   -5.629300      8.1000002E-03  0.2717000    
 C   -10.52570       1.392400     -6.6100001E-02
 C   -3.272500     -0.6967000      0.3373000    
 C   -4.327800     -0.3019000     -0.3875000    
 H    3.686700      0.8754000     -0.1192000    
 H    4.019700     -0.2012000       1.233500    
 H    3.177400      -2.149000     -0.1380000    
 H    2.776500      -1.026300      -1.440300    
 H    5.311400     -0.3643000      -1.526600    
 H    5.597900      -1.504100     -0.2214000    
 H    1.648700     -0.9179000       1.411200    
 H    1.258300      0.2204000      0.1267000    
 H    6.523000      0.3579000       1.184100    
 H    6.276500       1.466400     -0.1511000    
 H   0.6482000      -2.779000      0.1109000    
 H   0.3437000      -1.702000      -1.243400    
 H    7.870600      0.1083000      -1.549400    
 H    8.141700     -0.9555000     -0.1460000    
 H   -1.006100      -1.506000       1.539600    
 H   -8.348400     -0.1354000      0.6688000    
 H   -7.882800       1.549700      0.8115000    
 H   -6.424100       1.342100      -1.191700    
 H   -6.923300     -0.3555000      -1.381400    
 H   -9.398100      0.3516000      -1.560600    
 H   -8.962700       2.048300      -1.380100    
 H   -1.905400     -0.9139000      -1.336000    
 H   -10.84200      0.4936000      0.4727000    
 H   -11.32320       1.672200     -0.7612000    
 H   -10.40460       2.203100      0.6593000    
 H   -3.349400     -0.7957000       1.417000    
 H   -4.278600     -0.1965000      -1.466300    
 H    10.90820       1.141500     -6.9799997E-02


%chk=000001429-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001429

0 1
O 10.384373 0.331963 -0.352350
O 9.058301 1.867793 0.775093
O -5.808702 0.023340 1.527295
C 4.101910 -0.104728 0.161605
C 2.962834 -1.026025 -0.329212
C 5.494518 -0.539482 -0.348512
C 1.574069 -0.614668 0.208793
C 6.629575 0.385279 0.142530
C 0.438699 -1.547764 -0.300126
C 8.010936 -0.076243 -0.359179
C -0.905133 -1.217608 0.297099
C -8.230820 0.656960 0.158948
C 9.144250 0.821889 0.095914
C -6.927298 0.411357 -0.620244
C -9.411780 1.037285 -0.761556
C -2.029857 -0.881587 -0.411418
C -5.723410 0.057129 0.259609
C -10.723076 1.272057 0.018967
C -3.302944 -0.570194 0.215605
C -4.455612 -0.240768 -0.455618
H 3.899885 0.936684 -0.163736
H 4.108270 -0.087900 1.271319
H 3.177614 -2.071194 -0.021882
H 2.942143 -1.026049 -1.439081
H 5.486524 -0.561004 -1.458673
H 5.693829 -1.580629 -0.018079
H 1.590049 -0.629165 1.317979
H 1.348665 0.428647 -0.088381
H 6.633897 0.420559 1.248979
H 6.443869 1.422877 -0.194643
H 0.711403 -2.591868 -0.032768
H 0.387190 -1.504635 -1.405427
H 8.038445 -0.117818 -1.466313
H 8.236469 -1.106074 -0.019251
H -0.968946 -1.245455 1.397342
H -8.483557 -0.249976 0.741744
H -8.062383 1.454350 0.908045
H -6.658505 1.308438 -1.219984
H -7.063359 -0.403023 -1.364317
H -9.568147 0.235394 -1.512844
H -9.153056 1.952180 -1.334014
H -1.980281 -0.846336 -1.510191
H -11.019554 0.362975 0.575326
H -11.555411 1.542413 -0.656714
H -10.604706 2.089361 0.755050
H -3.360337 -0.601418 1.314624
H -4.467795 -0.191916 -1.553687
H 11.106752 0.942799 -0.040961


