%chk=000030762.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030762

0 1
 O   0.3259000       1.246700     -0.6261000    
 O    4.156300     -0.4792000       1.032600    
 O  -0.1140000      -1.388200     -0.5294000    
 O    2.149900       1.897900      -1.852900    
 O   -3.293300      -2.794300     -0.8867000    
 O   -2.087300      -1.540300      -2.232400    
 N   -3.437500       2.237400      0.9963000    
 N    3.092000      -1.348400       1.239000    
 N   -2.232800      -2.148300      -1.131800    
 C   -1.937800       1.971400     -0.9210000    
 C   -2.058900       2.378800      0.5439000    
 C  -0.5028000       2.087700      -1.416600    
 C    2.456300      0.3467000     -8.9800000E-02
 C    2.077100     -0.8224000      0.5474000    
 C   -3.555100       2.594400       2.411300    
 C   -3.915000      0.8711000      0.7763000    
 C    1.662200       1.233800     -0.9440000    
 C    3.754700      0.5381000      0.2284000    
 C   0.7511000      -1.466100      0.5159000    
 C   0.2155000      -2.225300       1.530400    
 C    4.767400       1.553500     -9.1799997E-02
 C   -1.060200      -2.640100       1.079500    
 C   -1.213600      -2.105100     -0.1785000    
 H   -2.591100       2.589600      -1.547900    
 H   -2.222300      0.9265000      -1.065600    
 H   -1.742600       3.424300      0.6478000    
 H   -1.385800       1.773100       1.164600    
 H  -0.4515000       1.772700      -2.465300    
 H  -0.1596000       3.125900      -1.337900    
 H   -4.601400       2.551800       2.734100    
 H   -2.967000       1.930900       3.055900    
 H   -3.219000       3.624100       2.577300    
 H   -4.118700      0.6719000     -0.2803000    
 H   -3.224200      0.1160000       1.168300    
 H   -4.880700      0.7216000       1.275300    
 H   0.6740000      -2.457100       2.481900    
 H    5.086600       1.459900      -1.134300    
 H    4.366800       2.561300      5.6100000E-02
 H    5.652800       1.450100      0.5436000    
 H   -1.774900      -3.252400       1.611300    


%chk=000030762-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000030762

0 1
O 0.489426 1.446780 -0.515379
O 4.366049 -0.705948 0.718217
O -0.137558 -1.292606 -0.347473
O 2.342600 2.311816 -1.630980
O -3.352329 -2.871752 -0.377344
O -2.450037 -1.284948 -1.777365
N -3.625520 2.113341 0.878213
N 3.194628 -1.521580 1.025547
N -2.399686 -2.070998 -0.749033
C -1.830021 2.115877 -0.887733
C -2.172504 2.231793 0.611769
C -0.378305 2.468866 -1.196877
C 2.586855 0.380810 -0.186338
C 2.150364 -0.835498 0.476173
C -3.972607 2.549760 2.245993
C -4.171101 0.775444 0.572535
C 1.826880 1.458976 -0.860572
C 3.973442 0.409908 -0.020532
C 0.844544 -1.457896 0.644401
C 0.378024 -2.332377 1.633149
C 5.047511 1.355228 -0.433672
C -0.946221 -2.727704 1.263703
C -1.219823 -2.073884 0.065017
H -2.477822 2.819372 -1.446488
H -2.035249 1.101540 -1.272829
H -1.849338 3.228847 0.972915
H -1.582393 1.471702 1.187558
H -0.158605 2.433134 -2.278303
H -0.086688 3.463336 -0.809726
H -5.069498 2.528836 2.374656
H -3.520635 1.908611 3.046060
H -3.629291 3.587630 2.406107
H -4.037118 0.529304 -0.493965
H -3.692160 -0.037972 1.179244
H -5.254208 0.761928 0.786128
H 0.939615 -2.637027 2.512913
H 5.808547 0.834251 -1.042075
H 4.605796 2.165849 -1.031841
H 5.560639 1.777483 0.449036
H -1.624697 -3.390233 1.794090


