%chk=000006471.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006471

0 1
 O  -0.3734000      0.9777000      0.7323000    
 O   0.9006000       1.858100     -0.9781000    
 N   -3.252600     -0.7262000     -0.3279000    
 C  -0.3453000     -0.3144000      9.1300003E-02
 C   -1.183300      -1.322500      0.9410000    
 C   -1.046500     -9.8700002E-02  -1.270700    
 C   -2.661800     -0.8744000       1.008800    
 C   -2.526300      0.2774000      -1.114200    
 C    1.132200     -0.6963000      3.0000000E-03
 C   -1.088100      -2.771400      0.4349000    
 C   -4.668000     -0.3713000     -0.2272000    
 C    1.744000     -0.8249000      -1.242700    
 C    1.864500     -0.9155000       1.168500    
 C   0.2960000       1.974000      7.9000004E-02
 C    3.092100      -1.173700      -1.323300    
 C    3.212700      -1.264300       1.088000    
 C   0.1699000       3.252000      0.8747000    
 C    3.826500      -1.393300     -0.1579000    
 C   0.9068000       4.407800      0.2205000    
 H  -0.8197000      -1.310000       1.977000    
 H   -1.007200      -1.032500      -1.849500    
 H  -0.6058000      0.6483000      -1.933000    
 H   -3.226600      -1.621700       1.581100    
 H   -2.734300      6.7900002E-02   1.568700    
 H   -2.616600       1.274500     -0.6640000    
 H   -2.965200      0.3392000      -2.117900    
 H   -1.693400      -3.433400       1.064300    
 H   -1.444600      -2.880300     -0.5934000    
 H  -6.0400002E-02  -3.144200      0.4768000    
 H   -4.820000      0.5856000      0.2850000    
 H   -5.220900      -1.145400      0.3165000    
 H   -5.120000     -0.3052000      -1.223100    
 H    1.218500     -0.6726000      -2.178800    
 H    1.410300     -0.8081000       2.149100    
 H    3.570400      -1.275800      -2.293000    
 H    3.785400      -1.432500       1.995300    
 H  -0.8929000       3.501400      0.9619000    
 H   0.5820000       3.079400       1.874500    
 H    4.876300      -1.664400     -0.2205000    
 H   0.5127000       4.608400     -0.7813000    
 H   0.7985000       5.317100      0.8196000    
 H    1.974800       4.187200      0.1220000    


%chk=000006471-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000006471

0 1
O -0.322215 1.006227 0.680170
O 0.860307 2.167668 -0.982555
N -3.215579 -0.647567 -0.373113
C -0.291277 -0.335658 -0.063673
C -1.137092 -1.240943 0.893604
C -1.009116 -0.194057 -1.424262
C -2.593612 -0.715183 0.971422
C -2.466829 0.273750 -1.259735
C 1.172170 -0.787767 -0.137724
C -1.106803 -2.731601 0.482429
C -4.652510 -0.324888 -0.310445
C 1.760971 -1.274695 -1.329499
C 1.962005 -0.752561 1.042344
C 0.308771 2.129419 0.139999
C 3.102534 -1.718619 -1.343386
C 3.302404 -1.190844 1.030955
C 0.235792 3.282191 1.135548
C 3.879452 -1.680480 -0.164376
C 0.514507 4.649623 0.484910
H -0.689825 -1.141246 1.902414
H -1.022438 -1.188418 -1.907273
H -0.454387 0.502233 -2.074135
H -3.190091 -1.407855 1.595593
H -2.598484 0.284321 1.472894
H -2.486043 1.324983 -0.870756
H -2.958241 0.283079 -2.250688
H -1.565377 -3.344291 1.280120
H -1.691729 -2.894309 -0.439088
H -0.076707 -3.095996 0.326321
H -4.863846 0.683118 0.131095
H -5.177984 -1.080641 0.300943
H -5.084193 -0.346769 -1.327632
H 1.183703 -1.298862 -2.258503
H 1.525276 -0.365490 1.970393
H 3.541920 -2.087830 -2.277034
H 3.897064 -1.151022 1.950808
H -0.750135 3.255025 1.633958
H 0.982380 3.073584 1.928649
H 4.920485 -2.022336 -0.176435
H -0.265124 4.905881 -0.253770
H 0.539673 5.443564 1.252184
H 1.481522 4.638266 -0.045372


