%chk=000089836.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089836

0 1
 O   -4.413500      -1.291000     -0.6609000    
 O   -1.419200       1.997100       1.489600    
 O    2.752100      -1.499300       1.154600    
 O    4.001800     -5.8899999E-02 -0.8669000    
 N   -2.317200      0.4913000     -5.5199999E-02
 C   -2.156700     -0.5166000      -1.110400    
 C   -3.706000      0.8421000      0.2378000    
 C   -3.059200      -1.713900     -0.8373000    
 C   -4.534900     -0.4140000      0.4624000    
 C   -1.280700       1.152900      0.6055000    
 C   0.1007000      0.8326000      0.2221000    
 C   0.7810000     -0.1925000      0.8746000    
 C   0.7240000       1.556800     -0.7910000    
 C    2.093400     -0.4954000      0.5115000    
 C    2.720800      0.2278000     -0.5030000    
 C    2.036100       1.253900      -1.154200    
 C    2.636100      -2.809100      0.6020000    
 C    5.041400      0.6363000     -0.1813000    
 H   -1.120700     -0.8444000      -1.214000    
 H   -2.453000     -2.9200001E-02  -2.046800    
 H   -4.078500       1.388900     -0.6364000    
 H   -3.771100       1.504900       1.105800    
 H   -3.030600      -2.406200      -1.684500    
 H   -2.733300      -2.262200      5.4699998E-02
 H   -4.222700     -0.9435000       1.370300    
 H   -5.592000     -0.1528000      0.5727000    
 H   0.2942000     -0.7575000       1.666000    
 H   0.1988000       2.357800      -1.304600    
 H    2.518400       1.820700      -1.945900    
 H    3.036000      -2.834200     -0.4166000    
 H    1.591000      -3.134700      0.6038000    
 H    3.217700      -3.495700       1.223100    
 H    5.008200      0.4194000      0.8911000    
 H    4.957300       1.714700     -0.3497000    
 H    6.001400      0.2942000     -0.5775000    


%chk=000089836-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000089836

0 1
O -4.844270 -0.869944 -0.855974
O -1.527970 1.005285 2.005985
O 3.120808 -1.212807 1.508435
O 4.027320 -0.102569 -1.050784
N -2.463426 0.574576 -0.083862
C -2.502618 -0.173154 -1.360717
C -3.799294 1.006946 0.391260
C -3.510879 -1.340831 -1.254950
C -4.765203 -0.190418 0.452578
C -1.373461 0.668028 0.786164
C 0.006570 0.402913 0.239240
C 0.923448 -0.293939 1.063199
C 0.450088 0.919123 -1.006748
C 2.252262 -0.501824 0.647679
C 2.703540 0.052874 -0.588064
C 1.791093 0.752009 -1.408294
C 3.634262 -2.486108 0.949074
C 5.073627 0.483202 -0.175385
H -1.503744 -0.570318 -1.598799
H -2.817955 0.507193 -2.177215
H -4.195046 1.764515 -0.313519
H -3.671680 1.459189 1.388784
H -3.648504 -1.825734 -2.235782
H -3.138655 -2.088884 -0.520538
H -4.429884 -0.909484 1.230127
H -5.793162 0.139339 0.674188
H 0.605806 -0.673306 2.039044
H -0.235106 1.494335 -1.638557
H 2.161231 1.173851 -2.347931
H 4.172054 -2.315253 -0.001230
H 2.797726 -3.191546 0.786058
H 4.317307 -2.886079 1.713548
H 5.020732 0.060745 0.843425
H 4.954317 1.581890 -0.133447
H 6.029767 0.226484 -0.655594


