%chk=000002954.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002954

0 1
 N   0.6234000      0.6512000     -0.1115000    
 N    6.794600      0.1342000     -3.6400001E-02
 N    5.627400       2.130600     -0.3719000    
 N   -6.746700     -0.6319000     -0.4814000    
 N   -6.403700       1.531900      0.3315000    
 C    1.919900      0.1941000     -3.6100000E-02
 C    1.857800      -1.180900      0.1998000    
 C  -0.2536000     -0.3847000      6.8200000E-02
 C   0.4804000      -1.532100      0.2628000    
 C   -1.683300     -0.1912000      3.6800001E-02
 C    3.130400      0.8858000     -0.1574000    
 C    3.061600      -1.903100      0.3211000    
 C    4.311500      0.1485000     -3.3500001E-02
 C    4.279900      -1.224600      0.2020000    
 C   -2.516500      -1.220500     -0.3995000    
 C   -2.230500       1.025200      0.4442000    
 C   -4.446600      0.1829000     -2.1199999E-02
 C   -3.898500      -1.033500     -0.4287000    
 C   -3.612500       1.212200      0.4152000    
 C    5.592100      0.8284000     -0.1529000    
 C   -5.887400      0.3774000     -5.0999999E-02
 H   0.3715000       1.613800     -0.2897000    
 H   8.3099999E-02  -2.523400      0.4380000    
 H    3.123400       1.955200     -0.3409000    
 H    3.050500      -2.973700      0.5047000    
 H    5.177300      -1.825700      0.3033000    
 H   -2.115400      -2.175600     -0.7297000    
 H   -1.610100       1.842700      0.8028000    
 H   -4.500500      -1.865000     -0.7782000    
 H   -4.006800       2.170600      0.7423000    
 H    7.677600      0.6273000     -0.1212000    
 H    6.860300     -0.8618000      0.1311000    
 H    6.609700       2.422400     -0.4231000    
 H   -7.749400     -0.4763000     -0.4965000    
 H   -6.436000      -1.544300     -0.7908000    
 H   -7.424000       1.475300      0.2381000    


%chk=000002954-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000002954

0 1
N 0.669675 0.680271 -0.040112
N 6.821968 0.125977 -0.310704
N 5.700625 2.173379 0.326919
N -6.822809 -0.721761 -0.045095
N -6.443661 1.661427 -0.248694
C 1.981268 0.200509 0.022987
C 1.901826 -1.237663 0.123578
C -0.237707 -0.396967 0.005093
C 0.504629 -1.586685 0.107797
C -1.690180 -0.192259 -0.036930
C 3.202683 0.894521 -0.004307
C 3.111513 -1.975880 0.225851
C 4.395215 0.140523 0.078282
C 4.336533 -1.287371 0.201980
C -2.559728 -1.268734 -0.367384
C -2.279824 1.076264 0.241530
C -4.535364 0.174884 -0.117673
C -3.954821 -1.090221 -0.403314
C -3.672301 1.255994 0.196128
C 5.697154 0.883774 0.039577
C -6.014327 0.417524 -0.140181
H 0.411889 1.654269 -0.182292
H 0.086273 -2.587406 0.200523
H 3.283192 1.983898 -0.070467
H 3.091376 -3.065708 0.333266
H 5.262055 -1.860080 0.332854
H -2.133353 -2.243724 -0.625534
H -1.650634 1.926039 0.532514
H -4.582061 -1.936418 -0.708288
H -4.131507 2.227548 0.401450
H 7.744721 0.554726 -0.315263
H 6.731374 -0.816625 -0.681989
H 6.639135 2.614380 0.234409
H -7.835389 -0.633598 -0.095939
H -6.437520 -1.629032 0.206249
H -7.481020 1.745626 -0.226518


