%chk=000088672.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088672

0 1
 O    4.224200      -1.304600      7.4100003E-02
 O    4.325900       1.028600     -5.4900002E-02
 O   -7.174000      0.7521000     -0.2635000    
 N   -1.307000     -0.8780000     -5.7900000E-02
 N   -1.642600      0.3275000     -0.1308000    
 C    7.148300      0.9951000      2.6300000E-02
 C    8.651900      0.7364000      0.1094000    
 C    6.356500     -0.3109000      6.0199998E-02
 C    9.441100       2.035800      0.1147000    
 C    4.863900     -6.7900002E-02  1.7600000E-02
 C    2.831800      -1.198200      4.1099999E-02
 C    2.148400      -1.080500       1.231200    
 C    2.196100      -1.213600      -1.180600    
 C   8.6800002E-02 -0.9855000     -2.4700001E-02
 C   0.7581000     -0.9728000       1.197800    
 C   0.8058000      -1.106000      -1.214000    
 C   -5.817200      0.6490000     -0.2309000    
 C   -3.043500      0.4351000     -0.1645000    
 C   -5.145800      0.6614000      0.9916000    
 C   -5.098200      0.5293000      -1.420200    
 C   -3.755300      0.5542000       1.024900    
 C   -3.707900      0.4221000      -1.387000    
 C   -7.892000      0.2285000      0.8527000    
 C   -9.255300     -0.2372000      0.3874000    
 H    6.916500       1.544900     -0.8944000    
 H    6.837900       1.635300      0.8616000    
 H    8.971500      0.1230000     -0.7410000    
 H    8.883600      0.1734000       1.021100    
 H    6.585500     -0.8578000      0.9818000    
 H    6.627700     -0.9309000     -0.8014000    
 H    9.255900       2.610800     -0.7983000    
 H    9.168600       2.657200      0.9737000    
 H    10.51400       1.827300      0.1731000    
 H    2.671000      -1.071200       2.182500    
 H    2.755600      -1.308000      -2.106000    
 H   0.2068000     -0.8803000       2.130000    
 H   0.2917000      -1.117700      -2.171600    
 H   -5.664800      0.7805000       1.938100    
 H   -5.615900      0.5187000      -2.375500    
 H   -3.239000      0.5715000       1.981100    
 H   -3.155500      0.3300000      -2.318200    
 H   -8.006500       1.014100       1.607700    
 H   -7.383000     -0.6365000       1.296300    
 H   -9.157200      -1.013700     -0.3784000    
 H   -9.810500      0.5898000     -6.7699999E-02
 H   -9.838800     -0.6361000       1.222000    


%chk=000088672-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000088672

0 1
O 4.313339 -0.208576 0.763579
O 4.976806 1.215168 -0.997745
O -7.630828 0.236020 -0.425026
N -1.346430 -0.317024 0.635014
N -1.989811 0.377177 -0.274117
C 7.777258 0.715600 -0.415219
C 9.181566 0.365809 0.124986
C 6.655040 0.123853 0.459365
C 10.312986 0.947839 -0.749315
C 5.263438 0.466837 -0.042659
C 2.896630 -0.138383 0.614112
C 2.199732 -0.916249 1.568126
C 2.202424 0.613265 -0.371332
C 0.077969 -0.205062 0.565431
C 0.795527 -0.947972 1.541581
C 0.796629 0.572553 -0.385945
C -6.240527 0.202443 -0.297666
C -3.409721 0.269431 -0.215978
C -5.540436 -0.548313 0.689952
C -5.523835 0.986081 -1.240481
C -4.136858 -0.511979 0.726257
C -4.122950 1.016412 -1.196394
C -8.443524 -0.559904 0.522122
C -9.903929 -0.343469 0.136962
H 7.671642 0.342644 -1.452382
H 7.659398 1.814558 -0.472488
H 9.290690 -0.736565 0.184962
H 9.283229 0.745830 1.162384
H 6.736748 0.486423 1.503899
H 6.735845 -0.978781 0.522895
H 10.256931 0.556471 -1.782435
H 10.243637 2.050428 -0.805123
H 11.308863 0.691474 -0.344132
H 2.771428 -1.480624 2.310255
H 2.753810 1.207367 -1.100269
H 0.227560 -1.540876 2.265312
H 0.231025 1.138805 -1.131952
H -6.082281 -1.154097 1.422251
H -6.087341 1.552911 -1.987145
H -3.576457 -1.080436 1.474966
H -3.547314 1.611846 -1.912315
H -8.242076 -0.214375 1.556415
H -8.158007 -1.628320 0.440550
H -10.087696 -0.679172 -0.897673
H -10.172396 0.724129 0.208848
H -10.562637 -0.916996 0.814067


