%chk=000002196.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002196

0 1
 O    1.023600       1.838900      0.2252000    
 O    1.289100      -2.450300     -0.1568000    
 O   -4.211400      0.5452000      0.3455000    
 N    2.115400     -0.2669000     -5.2200001E-02
 C    4.310800      0.5133000      0.1076000    
 C    3.475500     -0.6463000     -0.3815000    
 C    3.409600       1.712000     -0.1268000    
 C    2.019500       1.149100      6.1700001E-02
 C    1.100900      -1.239700     -5.1700000E-02
 C  -0.2910000     -0.7719000      5.2299999E-02
 C   -1.012900     -0.4827000      -1.102800    
 C  -0.8791000     -0.6207000       1.305400    
 C   -2.331800     -3.9500002E-02  -1.004100    
 C   -2.198000     -0.1774000       1.404200    
 C   -2.924300      0.1132000      0.2493000    
 C   -4.895800      0.8237000     -0.8750000    
 H    5.271900      0.5939000     -0.4075000    
 H    4.508000      0.4055000       1.181400    
 H    3.539100     -0.7633000      -1.469500    
 H    3.748000      -1.595100      9.0400003E-02
 H    3.499400       2.088700      -1.150500    
 H    3.606400       2.515500      0.5869000    
 H  -0.5588000     -0.5983000      -2.083500    
 H  -0.3213000     -0.8442000       2.210900    
 H   -2.837700      0.1683000      -1.940800    
 H   -2.654200     -6.0199998E-02   2.383300    
 H   -5.005500     -7.6499999E-02  -1.489300    
 H   -4.422700       1.645400      -1.423300    
 H   -5.905400       1.155200     -0.6110000    


%chk=000002196-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000002196

0 1
O 1.484301 2.186334 0.188105
O 1.334646 -1.673059 -1.622347
O -4.318135 0.585009 0.461625
N 2.216517 -0.062638 -0.218006
C 4.454151 0.097234 0.597153
C 3.539409 -0.754594 -0.314282
C 3.865134 1.519410 0.468689
C 2.376814 1.305887 0.156365
C 1.094347 -0.710250 -0.828911
C -0.292786 -0.299909 -0.489218
C -1.312847 -0.637071 -1.416659
C -0.662424 0.311072 0.741604
C -2.665016 -0.353386 -1.152002
C -2.007754 0.579194 1.029211
C -3.014082 0.259119 0.080690
C -5.402758 0.289724 -0.481123
H 5.510059 0.035759 0.287549
H 4.381899 -0.253316 1.641839
H 3.881103 -0.760095 -1.365777
H 3.435427 -1.802691 0.006779
H 4.311533 2.077958 -0.376679
H 3.972919 2.146266 1.368360
H -1.023074 -1.132972 -2.348752
H 0.099978 0.572973 1.478500
H -3.426548 -0.611360 -1.893501
H -2.307107 1.042111 1.973736
H -5.473948 -0.796185 -0.683371
H -5.266221 0.839165 -1.432129
H -6.318235 0.635211 0.020353


