%chk=000003449.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003449

0 1
 O   -1.779800     -0.1547000     -0.8469000    
 O   -2.989500      -2.246500      0.8707000    
 O   -2.651300       2.552000     -0.5663000    
 N    3.400900      0.2370000     -0.2373000    
 C   0.4261000      -1.033300     -0.2645000    
 C  -0.8350000      -1.207900      -1.170300    
 C   0.3130000      0.4450000     -6.4999998E-02
 C    1.691000      -1.446200      -1.041200    
 C   -1.509600      -2.574900      -1.027900    
 C   0.3000000      -1.772500       1.053500    
 C  -0.9748000      0.8596000     -0.3935000    
 C    3.042500      -1.188100     -0.3577000    
 C    1.254700       1.349800      0.4064000    
 C   -1.823900      -2.934600      0.4266000    
 C    2.640100      0.9258000      0.8209000    
 C  -0.7086000      -2.598700       1.363600    
 C   -1.389300       2.168500     -0.2525000    
 C   0.8464000       2.688700      0.5440000    
 C  -0.4598000       3.092200      0.2182000    
 C    4.838100      0.3471000      4.6799999E-02
 C   -3.631100       2.491900      0.4725000    
 H  -0.5809000      -1.065400      -2.231400    
 H    1.709600     -0.9438000      -2.019200    
 H    1.632100      -2.521200      -1.262100    
 H  -0.8428000      -3.338200      -1.448200    
 H   -2.437200      -2.580000      -1.612900    
 H    1.061100      -1.601700       1.810700    
 H    3.101300      -1.698600      0.6114000    
 H    3.788800      -1.679100     -0.9976000    
 H   -2.033500      -4.008400      0.4904000    
 H    3.181100       1.839500       1.102800    
 H    2.586200      0.3271000       1.739500    
 H  -0.7283000      -3.055100       2.349600    
 H    1.541000       3.437100      0.9193000    
 H  -0.7394000       4.135400      0.3419000    
 H    5.106900     -0.1242000      0.9992000    
 H    5.147200       1.398100      7.9300001E-02
 H    5.428200     -0.1191000     -0.7504000    
 H   -3.722500      -2.501700      0.2850000    
 H   -4.586800       2.827800      6.1200000E-02
 H   -3.352000       3.152500       1.299400    
 H   -3.745000       1.464400      0.8324000    


%chk=000003449-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003449

0 1
O -1.794596 0.001209 -0.781638
O -3.050895 -2.106208 1.193936
O -2.610198 2.895320 -0.192020
N 3.465371 0.202844 -0.256546
C 0.407850 -0.969296 -0.255381
C -0.892098 -1.159507 -1.107446
C 0.350351 0.538715 0.029627
C 1.656715 -1.392011 -1.081281
C -1.645288 -2.469053 -0.884902
C 0.317144 -1.704691 1.080860
C -0.955217 1.001254 -0.240419
C 3.034719 -1.210846 -0.409780
C 1.353262 1.398743 0.518583
C -1.898376 -2.825756 0.595952
C 2.764626 0.929165 0.841345
C -0.706281 -2.506274 1.467466
C -1.343245 2.335489 0.026435
C 0.982727 2.752699 0.737031
C -0.335085 3.205380 0.511360
C 4.935511 0.294913 -0.093901
C -3.782608 2.003332 -0.086010
H -0.636882 -1.044852 -2.181354
H 1.665381 -0.812539 -2.024423
H 1.550338 -2.465899 -1.341289
H -1.038727 -3.280374 -1.335335
H -2.601282 -2.440109 -1.443770
H 1.133891 -1.512938 1.788345
H 3.064078 -1.753986 0.570833
H 3.779676 -1.707460 -1.059865
H -2.108978 -3.918040 0.650176
H 3.369836 1.821301 1.083104
H 2.752802 0.301575 1.773549
H -0.717293 -2.934309 2.477326
H 1.734245 3.464214 1.098163
H -0.614678 4.246604 0.700403
H 5.317229 -0.187785 0.842084
H 5.241598 1.355832 -0.080296
H 5.432937 -0.189710 -0.952803
H -3.833836 -2.222357 0.595784
H -4.650974 2.679130 -0.117778
H -3.764594 1.444221 0.867943
H -3.813955 1.287657 -0.923668


