%chk=000002481.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002481

0 1
 O   -1.637800     -0.2416000      -1.953200    
 O   0.9371000      0.7971000       1.833800    
 O   0.3367000      -3.560100      0.5259000    
 N  -0.5687000      -1.891300     -0.7706000    
 N   0.7169000      -1.372400       1.121500    
 C   0.1112000      0.4395000     -0.4179000    
 C  -0.6099000       1.790000     -0.2980000    
 C   -1.947000       1.694400      0.4462000    
 C    1.355400      0.6047000      -1.308900    
 C  -0.8029000     -0.5670000      -1.109400    
 C   0.6023000       0.000000      0.9578000    
 C   -2.919100      0.7161000     -0.2147000    
 C   -1.692500       1.271100       1.894900    
 C    2.345000       1.522200     -0.6714000    
 C   0.1868000      -2.358400      0.2981000    
 C    3.586400       1.155500     -0.3339000    
 H   2.0000001E-03   2.541600      0.2151000    
 H  -0.8081000       2.197700      -1.299200    
 H   -2.404200       2.692000      0.4520000    
 H    1.075700       1.010100      -2.290000    
 H    1.815700     -0.3722000      -1.510100    
 H   -2.778900     -0.3434000      8.0000004E-03
 H   -3.163700      0.9869000      -1.245700    
 H   -3.887100      0.8942000      0.2838000    
 H   -1.495700      0.2067000       2.033300    
 H   -2.624000       1.436900       2.455000    
 H  -0.9606000       1.910800       2.394600    
 H   -1.065400      -2.593000      -1.312300    
 H    1.168200      -1.691600       1.974200    
 H    2.072800       2.564100     -0.5289000    
 H    4.273400       1.875100      9.7800002E-02
 H    3.937700      0.1397000     -0.4770000    


%chk=000002481-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002481

0 1
O -1.069175 -0.388076 -2.350786
O 1.243445 0.632433 1.812997
O -0.162121 -3.679288 0.801274
N -0.626368 -1.980563 -0.736554
N 0.571208 -1.502166 1.241570
C 0.198641 0.373597 -0.392911
C -0.642526 1.688330 -0.233887
C -2.007298 1.656742 0.521855
C 1.488769 0.687083 -1.287094
C -0.565839 -0.663357 -1.230812
C 0.695427 -0.121576 0.970301
C -3.109696 0.821768 -0.175685
C -1.900974 1.271821 2.017633
C 2.488536 1.653722 -0.697531
C -0.074873 -2.473624 0.460466
C 3.821539 1.412644 -0.636580
H 0.011115 2.413267 0.284556
H -0.823139 2.063759 -1.259363
H -2.341782 2.716365 0.488193
H 1.078682 1.085558 -2.236421
H 1.999387 -0.264894 -1.531580
H -2.924925 -0.264803 -0.080362
H -3.184299 1.056021 -1.252171
H -4.089583 1.024806 0.294692
H -1.679288 0.195580 2.149052
H -2.863478 1.466399 2.526230
H -1.110648 1.843208 2.535148
H -1.101228 -2.674467 -1.323649
H 0.960516 -1.833738 2.130442
H 2.104017 2.618500 -0.342061
H 4.519766 2.158044 -0.241170
H 4.253892 0.462303 -0.974989


