%chk=000025585.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025585

0 1
 O    1.227900      0.3277000      0.6313000    
 O    3.910500     -0.1075000      0.7296000    
 O   -1.365200      -2.577600     -0.5444000    
 O   -6.541500      0.8107000      9.2600003E-02
 N    3.973900       2.587300     -0.1799000    
 C   0.8600000      -1.939800     -0.1368000    
 C    1.695600     -0.9072000      0.2727000    
 C   -1.057600     -0.3425000      0.2104000    
 C  -0.5884000      -1.700400     -0.1886000    
 C    3.075500      -1.107400      0.3309000    
 C  -0.1387000      0.5718000      0.5888000    
 C   -2.482900     -4.3299999E-02  0.1803000    
 C    5.179500       1.798300      2.4700001E-02
 C    4.899800      0.3214000     -0.2039000    
 C    1.394200      -3.181600     -0.4915000    
 C    3.613700      -2.344900     -2.2100000E-02
 C    2.774100      -3.380500     -0.4326000    
 C  -0.4567000       1.977900       1.016700    
 C   -3.266000     -0.2719000       1.310200    
 C   -3.059900      0.4715000     -0.9793000    
 C    3.448700       2.389600      -1.533100    
 C    4.238100       4.008600      5.6800000E-02
 C   -4.630700      1.5100000E-02   1.280400    
 C   -4.424600      0.7587000      -1.009100    
 C   -5.210100      0.5305000      0.1209000    
 C   -7.069200       1.335500      -1.124800    
 H    5.517700       1.929700       1.060300    
 H    5.994000       2.123100     -0.6350000    
 H    5.818200     -0.2405000      6.8000001E-03
 H    4.625500      9.4599999E-02  -1.241000    
 H   0.7565000      -4.000100     -0.8133000    
 H    4.685100      -2.519900      2.5400000E-02
 H    3.195000      -4.344100     -0.7053000    
 H  -0.1035000       2.141700       2.040400    
 H   -1.520600       2.225100      0.9939000    
 H   5.8800001E-02   2.688700      0.3617000    
 H   -2.829200     -0.6734000       2.221400    
 H   -2.459900      0.6541000      -1.867700    
 H    4.209600       2.554200      -2.304800    
 H    2.624900       3.088000      -1.725300    
 H    3.009000       1.397100      -1.666500    
 H    4.978500       4.413600     -0.6425000    
 H    4.603800       4.166900       1.077500    
 H    3.315900       4.592800     -3.8300000E-02
 H   -5.237500     -0.1648000       2.163700    
 H   -4.809600       1.156700      -1.941700    
 H   -6.628800       2.308500      -1.367800    
 H   -8.140400       1.499600     -0.9686000    
 H   -6.972000      0.6188000      -1.947400    


%chk=000025585-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000025585

0 1
O 0.768207 0.629271 0.209544
O 3.433596 0.391519 0.127678
O -1.835715 -2.386689 -1.000923
O -7.165601 0.581725 0.787424
N 5.422086 2.672201 -0.560513
C 0.427796 -1.636628 -0.662608
C 1.280591 -0.588194 -0.253024
C -1.532724 -0.176502 -0.034445
C -1.049007 -1.465351 -0.598312
C 2.702335 -0.713359 -0.300884
C -0.619120 0.812774 0.304443
C -2.998046 0.024636 0.148916
C 5.459591 1.656031 0.510638
C 4.905771 0.298056 0.067770
C 0.999789 -2.850542 -1.132623
C 3.246402 -1.928952 -0.768912
C 2.392985 -2.988448 -1.181095
C -0.899236 2.213178 0.776706
C -3.530296 0.506130 1.379254
C -3.912349 -0.300898 -0.885497
C 6.549705 2.564862 -1.503124
C 5.219796 4.047198 -0.068191
C -4.912579 0.682098 1.561516
C -5.302985 -0.124788 -0.721762
C -5.806313 0.371263 0.506566
C -8.131618 0.244506 -0.260782
H 4.842566 2.004099 1.358348
H 6.497504 1.500488 0.904847
H 5.245627 -0.507884 0.751943
H 5.222437 0.054793 -0.965968
H 0.318683 -3.647619 -1.443658
H 4.330331 -2.065097 -0.816578
H 2.840811 -3.921377 -1.539237
H -0.723696 2.312966 1.864313
H -1.939647 2.500178 0.565677
H -0.211300 2.912570 0.270378
H -2.853309 0.717531 2.214839
H -3.532362 -0.706146 -1.826599
H 7.541957 2.796645 -1.035193
H 6.397834 3.262125 -2.346016
H 6.605553 1.544319 -1.922911
H 6.070059 4.437369 0.548197
H 4.300935 4.090799 0.541993
H 5.088468 4.729263 -0.927681
H -5.322000 1.042797 2.509894
H -5.974563 -0.383870 -1.545643
H -7.972264 0.858537 -1.168674
H -9.116726 0.472063 0.172389
H -8.078956 -0.829245 -0.526317


