%chk=000006706.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000006706

0 1
 O   0.2864000       2.331400      0.1062000    
 O   -1.182900      -2.803300     -7.4299999E-02
 N    2.824500       1.725800      0.1489000    
 C   0.9890000      6.8499997E-02  5.7100002E-02
 C   0.5951000      -1.270300      8.5000005E-03
 C   -1.453100      0.7881000      2.3800001E-02
 C   -1.846900     -0.5508000     -2.4400000E-02
 C  -2.0800000E-02   1.146700      6.6100001E-02
 C    2.349800      0.3951000      9.7800002E-02
 C  -0.8372000      -1.628900     -3.3599999E-02
 C    1.562100      -2.282700       0.000000    
 C    3.310200     -0.6170000      8.9299999E-02
 C   -2.420100       1.800500      3.2000002E-02
 C   -3.207800     -0.8772000     -6.4400002E-02
 C    2.917100      -1.953000      4.0199999E-02
 C   -3.775200       1.470800     -7.7000000E-03
 C   -4.168200      0.1347000     -5.5599999E-02
 C    4.078100       2.121600     -0.4096000    
 H    1.281500      -3.331900     -3.6800001E-02
 H    4.375100     -0.4083000      0.1325000    
 H   -2.142200       2.850400      6.8999998E-02
 H   -3.540000      -1.911200     -0.1023000    
 H    3.666200      -2.739600      3.6600001E-02
 H    2.145000       2.454300      0.3326000    
 H   -4.524900       2.256700     -1.1000000E-03
 H   -5.223800     -0.1194000     -8.6499996E-02
 H    4.198500       1.757500      -1.435500    
 H    4.919500       1.777800      0.2002000    
 H    4.135100       3.214700     -0.4429000    


%chk=000006706-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000006706

0 1
O 0.285144 2.426228 -0.080597
O -1.215640 -2.892532 0.044882
N 2.803736 1.741626 -0.129314
C 0.976262 0.107051 -0.055599
C 0.581437 -1.273020 -0.021706
C -1.476356 0.790634 -0.015656
C -1.879868 -0.575093 0.015952
C -0.033539 1.170274 -0.052229
C 2.392798 0.431281 -0.092877
C -0.864355 -1.668343 0.015359
C 1.541964 -2.302346 -0.022712
C 3.345268 -0.643507 -0.091439
C -2.460159 1.810784 -0.013841
C -3.258100 -0.903008 0.048534
C 2.920909 -1.977860 -0.057014
C -3.828861 1.477285 0.018690
C -4.229982 0.116642 0.049876
C 4.201317 2.165963 -0.173520
H 1.194362 -3.338814 0.003880
H 4.414459 -0.414710 -0.116373
H -2.123069 2.851441 -0.038483
H -3.535686 -1.961566 0.072365
H 3.667907 -2.779281 -0.056078
H 2.025516 2.430677 -0.122024
H -4.584933 2.269929 0.019783
H -5.294575 -0.139662 0.075074
H 4.725295 1.775254 -1.068615
H 4.764337 1.839321 0.723668
H 4.234511 3.266349 -0.213884


