%chk=000005962.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005962

0 1
 O   -2.790800      -1.623500     -0.3318000    
 O   -3.563700      0.2615000      0.6609000    
 N   -1.502600       1.769000     -7.1800001E-02
 N    4.857900     -0.3942000      0.2918000    
 C    1.167400      0.3292000     -0.3051000    
 C  -0.1555000     -0.2958000      0.1586000    
 C    2.406600     -0.3826000      0.2435000    
 C   -1.413500      0.3533000     -0.4323000    
 C    3.688300      0.3006000     -0.2331000    
 C   -2.694200     -0.3175000      1.9500000E-02
 H    1.200300       1.381800      8.9999998E-04
 H    1.201600      0.3162000      -1.401700    
 H  -0.2045000     -0.2620000       1.255400    
 H  -0.1479000      -1.361400     -0.1051000    
 H    2.398200      -1.430600     -8.1000000E-02
 H    2.368900     -0.3832000       1.340100    
 H   -1.382900      0.2891000      -1.526300    
 H    3.707700       1.344500      9.8499998E-02
 H    3.732600      0.2970000      -1.327500    
 H   -1.567400       1.867600      0.9405000    
 H   -2.352500       2.175000     -0.4609000    
 H    4.841700     -0.3724000       1.310600    
 H    5.701400      0.1029000      8.8000000E-03
 H   -3.627300      -2.026900     -1.6000001E-02


%chk=000005962-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005962

0 1
O -2.871548 -1.523686 -0.751947
O -3.445345 -0.133691 1.020064
N -1.498232 1.810296 0.072461
N 4.876616 -0.336854 0.385207
C 1.132129 0.296386 -0.356850
C -0.172118 -0.297159 0.214575
C 2.392570 -0.310647 0.297287
C -1.439736 0.407690 -0.356879
C 3.701595 0.273702 -0.272095
C -2.682594 -0.397705 0.063854
H 1.111583 1.393679 -0.215040
H 1.163404 0.115903 -1.452014
H -0.180354 -0.195037 1.319550
H -0.228435 -1.378685 -0.013914
H 2.415731 -1.409244 0.160649
H 2.360168 -0.128010 1.393203
H -1.379393 0.372182 -1.460274
H 3.660585 1.388321 -0.185066
H 3.757882 0.041565 -1.353510
H -1.667840 1.905004 1.081117
H -2.158272 2.382173 -0.465091
H 4.906243 -0.180457 1.398415
H 5.773471 -0.115871 -0.058605
H -3.658309 -2.042256 -0.428598


