%chk=000008455.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008455

0 1
 O    2.402300       2.046200      0.4630000    
 C    2.269700     -0.6263000     -0.5359000    
 C   -2.701600     -0.1991000     -0.4067000    
 C    1.056400      0.1914000     -0.2393000    
 C   -1.306700      0.4088000     -0.1705000    
 C    3.200900     -0.8198000      0.7227000    
 C   -2.901600      -1.499600      0.4313000    
 C  -0.2069000     -0.3602000     -0.4524000    
 C    3.140300      8.3999999E-02  -1.625100    
 C    1.991400      -2.053500      -1.120600    
 C   -2.824900     -0.5702000      -1.906000    
 C   -3.866700      0.7734000     -0.1024000    
 C    1.176000       1.493000      0.2479000    
 C   -1.231100       1.691100      0.3096000    
 C   3.2299999E-02   2.242900      0.5224000    
 C    2.516900      -1.470400       1.921700    
 C   -2.746600      -1.331900       1.940200    
 H    4.059700      -1.444500      0.4415000    
 H    3.635700      0.1293000       1.051900    
 H   -3.902700      -1.906000      0.2343000    
 H   -2.200700      -2.278400      0.1056000    
 H  -0.3359000      -1.366800     -0.8256000    
 H    3.585200       1.023200      -1.286600    
 H    2.542900      0.3035000      -2.518200    
 H    3.975400     -0.5555000      -1.936500    
 H    2.928600      -2.592600      -1.305000    
 H    1.463300      -1.995200      -2.080100    
 H    1.396500      -2.672900     -0.4413000    
 H   -2.118000      -1.350500      -2.207900    
 H   -2.645400      0.3021000      -2.546100    
 H   -3.828400     -0.9481000      -2.135600    
 H   -4.833500      0.2880000     -0.2848000    
 H   -3.835300       1.660200     -0.7472000    
 H   -3.877000       1.109000      0.9400000    
 H   -2.083500       2.317100      0.5390000    
 H   0.1117000       3.257900      0.9028000    
 H    3.232500      -1.571500       2.744500    
 H    2.147900      -2.471900       1.684900    
 H    1.679700     -0.8683000       2.286400    
 H   -2.903400      -2.295700       2.436100    
 H   -3.481300     -0.6318000       2.347100    
 H   -1.745900     -0.9831000       2.210700    
 H    2.287800       2.950700      0.8014000    


%chk=000008455-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000008455

0 1
O 2.498190 2.086198 0.465248
C 2.361395 -0.664800 -0.556402
C -2.770437 -0.197905 -0.423747
C 1.111331 0.194025 -0.243401
C -1.386563 0.444095 -0.167723
C 3.250827 -0.833987 0.727109
C -2.918207 -1.522942 0.405122
C -0.202535 -0.297240 -0.434992
C 3.209499 0.042352 -1.659657
C 1.984401 -2.070584 -1.095053
C -2.893601 -0.557211 -1.936650
C -3.937645 0.760235 -0.070288
C 1.212015 1.530572 0.250739
C -1.228856 1.760178 0.322304
C 0.060275 2.296772 0.526595
C 2.554106 -1.497997 1.934788
C -2.804385 -1.365321 1.936357
H 4.137178 -1.434970 0.436034
H 3.621915 0.162033 1.025084
H -3.899345 -1.973602 0.149329
H -2.149489 -2.243818 0.061807
H -0.311601 -1.317734 -0.812766
H 3.538722 1.040496 -1.329446
H 2.623085 0.155554 -2.590460
H 4.107081 -0.563093 -1.890538
H 2.911281 -2.641731 -1.288115
H 1.428051 -2.005492 -2.048690
H 1.376898 -2.653358 -0.379658
H -2.107113 -1.267001 -2.251027
H -2.801381 0.348266 -2.564032
H -3.875341 -1.024816 -2.143272
H -4.902215 0.249631 -0.248267
H -3.919427 1.668311 -0.701283
H -3.916531 1.077364 0.987557
H -2.099323 2.381623 0.549839
H 0.168499 3.322523 0.906666
H 3.236185 -1.528099 2.804836
H 2.246566 -2.538059 1.720307
H 1.651920 -0.933296 2.233740
H -2.864692 -2.350777 2.434217
H -3.615650 -0.737372 2.347180
H -1.840724 -0.902489 2.216384
H 2.411643 3.011465 0.805426


