%chk=000064855.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064855

0 1
 O  -0.3176000      -2.201600      -2.228400    
 O    5.167700       2.472200     -0.9140000    
 O    5.953700      -1.600200       1.480800    
 O    6.720700      0.9803000      0.8268000    
 N   -4.111500     -0.1619000      4.7400001E-02
 N   -1.647200      -1.427300     -0.4901000    
 C   -3.943500     -0.9179000      -1.204300    
 C   -2.881300      0.3742000      0.6463000    
 C   -2.877300      -1.997600      -1.033300    
 C   -1.829900     -0.7269000      0.7825000    
 C   -5.324600      0.5080000      0.2440000    
 C  -0.4396000      -1.589600      -1.164300    
 C   0.7760000     -0.9637000     -0.5288000    
 C   -6.432300     -0.1062000      0.8783000    
 C    2.013500      -1.223100      -1.374900    
 C   -5.490200       1.844700     -0.1913000    
 C    3.272500     -0.6344000     -0.7862000    
 C   -7.633900      0.5771000       1.065600    
 C   -6.321600      -1.515900       1.360900    
 C   -6.691800       2.527800     -3.8000001E-03
 C   -7.763600       1.894100      0.6245000    
 C    4.037200      -1.396300      8.2999997E-02
 C    3.641000      0.6576000      -1.125800    
 C    4.804400       1.202000     -0.5821000    
 C    5.200700     -0.8520000      0.6268000    
 C    5.584400      0.4473000      0.2943000    
 C    4.315700       3.175300      -1.816100    
 C    5.643400      -1.507100       2.869700    
 C    6.575000       2.161200       1.612300    
 H   -3.651900     -0.2250000      -2.003600    
 H   -4.884700      -1.393300      -1.504900    
 H   -3.088200      0.7914000       1.639100    
 H   -2.492600       1.183400      1.5500000E-02
 H   -2.692200      -2.493000      -1.991500    
 H   -3.219400      -2.763200     -0.3263000    
 H   -2.160000      -1.475500       1.513200    
 H  -0.9001000     -0.2973000       1.158900    
 H   0.6121000      0.1157000     -0.4318000    
 H   0.9148000      -1.390700      0.4711000    
 H    2.160200      -2.303300      -1.512900    
 H    1.872600     -0.8239000      -2.388900    
 H   -4.669600       2.358100     -0.6885000    
 H   -8.479400      9.7999997E-02   1.552100    
 H   -6.253300      -2.205500      0.5135000    
 H   -7.191600      -1.810200       1.958000    
 H   -5.440300      -1.639300       1.999400    
 H   -6.793400       3.552700     -0.3483000    
 H   -8.699400       2.425900      0.7697000    
 H    3.739500      -2.408300      0.3445000    
 H    2.992300       1.194600      -1.809000    
 H    4.278000       2.690100      -2.797400    
 H    4.756500       4.166000      -1.968900    
 H    3.319300       3.333900      -1.389600    
 H    4.619700      -1.846700       3.057200    
 H    6.332500      -2.154700       3.418700    
 H    5.769700     -0.4802000       3.226500    
 H    5.586400       2.227900       2.080200    
 H    7.326400       2.131700       2.406900    
 H    6.766600       3.045800      0.9985000    


%chk=000064855-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000064855

0 1
O -0.537885 -2.135428 -2.337665
O 5.404613 2.297888 -1.067356
O 5.544440 -1.509339 2.029914
O 6.705162 1.010672 1.006063
N -4.289030 -0.282216 0.235519
N -1.773423 -1.468695 -0.486536
C -4.094156 -0.872759 -1.117315
C -3.026205 0.273878 0.763976
C -3.029285 -1.984247 -1.073182
C -1.951369 -0.835666 0.833105
C -5.496308 0.461867 0.464531
C -0.574078 -1.593456 -1.186563
C 0.695477 -1.045967 -0.513119
C -6.762465 -0.212456 0.465058
C 1.970987 -1.378686 -1.327350
C -5.452988 1.857144 0.743576
C 3.208830 -0.743736 -0.709842
C -7.931614 0.549271 0.706430
C -6.869389 -1.716429 0.284449
C -6.632048 2.589009 0.996790
C -7.884119 1.937630 0.966126
C 3.866270 -1.353631 0.375069
C 3.694568 0.496026 -1.200455
C 4.828142 1.096474 -0.612002
C 4.994859 -0.750347 0.988688
C 5.496290 0.487724 0.495938
C 4.846704 2.894708 -2.282329
C 6.424796 -0.903301 3.041885
C 6.637282 2.358481 1.607461
H -3.773567 -0.086473 -1.840735
H -5.046430 -1.289379 -1.479300
H -3.204421 0.668056 1.780013
H -2.634859 1.106596 0.129123
H -2.795719 -2.354511 -2.084698
H -3.402985 -2.825459 -0.454901
H -2.279847 -1.600648 1.566301
H -1.002078 -0.403764 1.183489
H 0.610906 0.054071 -0.400142
H 0.796595 -1.455548 0.510847
H 2.079435 -2.476828 -1.380401
H 1.825810 -1.033213 -2.365673
H -4.491159 2.380539 0.745855
H -8.898877 0.031082 0.717110
H -6.985517 -2.010621 -0.777666
H -7.749183 -2.109296 0.823204
H -5.963946 -2.218004 0.670837
H -6.571167 3.663176 1.205794
H -8.807404 2.495100 1.157151
H 3.528177 -2.314426 0.776989
H 3.192113 0.964538 -2.052282
H 4.900724 2.190416 -3.134366
H 5.476553 3.773591 -2.485334
H 3.797154 3.214918 -2.131813
H 5.954261 -0.010343 3.497117
H 6.541626 -1.690137 3.804101
H 7.398530 -0.624012 2.611435
H 5.946196 2.363832 2.474841
H 7.662835 2.576948 1.943722
H 6.312687 3.100584 0.859717


