%chk=000061053.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061053

0 1
 O   -4.134000     -0.3817000      2.4700001E-02
 O    2.192800      -1.808700      0.2601000    
 O    3.836300      0.8047000       1.496800    
 N    1.339200      0.1651000     -0.6850000    
 C  -5.8100000E-02  2.5699999E-02 -0.5045000    
 C   -2.790900     -0.2468000     -0.1484000    
 C  -0.9013000       1.033700     -0.9405000    
 C  -0.5508000      -1.115600      0.1057000    
 C    3.718200     -0.2332000     -0.6751000    
 C   -2.277700      0.8965000     -0.7611000    
 C   -1.927300      -1.252900      0.2851000    
 C    2.331800     -0.7328000     -0.3157000    
 C   -4.890200      0.8160000      0.1967000    
 C    4.399100      0.5368000      0.4362000    
 C   -6.102100      0.5154000       1.052500    
 C    5.814800      0.9780000      0.1723000    
 H  -0.5119000       1.925300      -1.424000    
 H   4.9699999E-02  -1.937400      0.4662000    
 H    1.630600       1.028700      -1.137800    
 H    3.671500      0.4065000      -1.563000    
 H    4.333400      -1.105700     -0.9220000    
 H   -2.916400       1.689800      -1.137900    
 H   -2.322600      -2.145600      0.7624000    
 H   -4.311000       1.594500      0.7091000    
 H   -5.211100       1.183000     -0.7843000    
 H   -6.712100       1.411600       1.196400    
 H   -6.719300     -0.2606000      0.5877000    
 H   -5.797300      0.1341000       2.032800    
 H    6.443400      0.1028000     -9.3999999E-03
 H    6.202000       1.516100       1.042100    
 H    5.835200       1.644100     -0.6937000    


%chk=000061053-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000061053

0 1
O -4.118688 -0.315211 0.390127
O 2.212567 -2.173462 -0.262976
O 3.495359 1.927558 -0.408215
N 1.474786 0.060427 -0.438411
C 0.071295 -0.063879 -0.221135
C -2.738496 -0.153712 0.182018
C -0.697259 1.127034 -0.219099
C -0.582196 -1.311569 -0.015664
C 3.870106 -0.464605 -0.773418
C -2.093016 1.092166 -0.019934
C -1.973316 -1.346111 0.182281
C 2.427700 -0.936250 -0.448917
C -4.955791 0.899453 0.399940
C 4.298233 0.946886 -0.371588
C -6.392584 0.444005 0.641114
C 5.739396 1.126934 0.063515
H -0.201753 2.093709 -0.373353
H 0.007171 -2.230225 -0.010921
H 1.852991 1.017425 -0.555483
H 3.987313 -0.535209 -1.876703
H 4.553143 -1.217204 -0.346256
H -2.654669 2.030538 -0.024065
H -2.489829 -2.297713 0.341579
H -4.609280 1.581123 1.204578
H -4.857901 1.424161 -0.573313
H -7.071150 1.316344 0.657135
H -6.721733 -0.241866 -0.157984
H -6.476298 -0.083418 1.606556
H 5.890712 0.641598 1.047694
H 5.986110 2.196083 0.148714
H 6.430976 0.632389 -0.643418


