%chk=000095981.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095981

0 1
 O    3.096100      -2.369000      6.1999999E-02
 N    1.278400      -1.132200     -2.6500000E-02
 N    1.860100      -2.392200      1.8999999E-02
 C   -2.045800      0.5373000      3.5000001E-03
 C  -0.1205000     -0.9500000     -1.9700000E-02
 C   -2.905500     -0.5868000     -7.1999999E-03
 C  -0.6555000      0.3385000     -3.1000001E-03
 C  -0.9660000      -2.055500     -3.0700000E-02
 C   -2.349700      -1.876500     -2.4400000E-02
 C    2.219000     -1.1400000E-02 -1.5699999E-02
 C   -2.601800       1.826800      2.0400001E-02
 C   -4.295700     -0.3883000     -7.9999998E-04
 C   -3.985400       2.005500      2.6799999E-02
 C   -4.830900      0.9000000      1.6300000E-02
 C    2.637500      0.4677000       1.196800    
 C    2.629100      0.4975000      -1.219000    
 C    3.533600       1.536600       1.206900    
 C    3.525300       1.566300      -1.208800    
 C    3.977600       2.085800      4.1999999E-03
 H  -1.7500000E-02   1.219000      5.4000001E-03
 H  -0.5912000      -3.075100     -4.6100002E-02
 H   -2.992200      -2.754700     -3.3599999E-02
 H   -1.960600       2.705800      2.8800000E-02
 H   -4.975500      -1.237900     -8.8999998E-03
 H   -4.402500       3.008300      3.9999999E-02
 H   -5.908000       1.039900      2.1299999E-02
 H    2.293000      4.3299999E-02   2.134600    
 H    2.278300      9.5500000E-02  -2.164200    
 H    3.885300       1.941400       2.151400    
 H    3.870900       1.994200      -2.145400    
 H    4.675300       2.918100      1.2000000E-02


%chk=000095981-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095981

0 1
O 2.952629 -2.556580 0.837461
N 1.290016 -1.063789 0.353197
N 1.697999 -2.396093 0.685138
C -2.111400 0.558284 0.075992
C -0.125630 -0.894408 0.172759
C -2.948410 -0.598664 -0.166709
C -0.701266 0.381447 0.249328
C -0.952480 -2.046954 -0.071722
C -2.325343 -1.889814 -0.231699
C 2.233419 0.016288 0.167444
C -2.723602 1.854570 0.143620
C -4.358850 -0.417853 -0.336963
C -4.103001 2.001093 -0.023719
C -4.928467 0.856884 -0.266987
C 3.150453 0.336733 1.196709
C 2.266965 0.708527 -1.068806
C 4.093674 1.366848 0.988109
C 3.208953 1.740481 -1.264226
C 4.125802 2.070794 -0.237771
H -0.076985 1.258053 0.449925
H -0.487695 -3.032393 -0.130388
H -2.951342 -2.769486 -0.422367
H -2.091969 2.731440 0.329882
H -4.988076 -1.296746 -0.521964
H -4.560809 2.994962 0.030741
H -6.008534 0.986641 -0.396321
H 3.120884 -0.206188 2.145273
H 1.560541 0.439797 -1.861260
H 4.804795 1.617079 1.782660
H 3.232453 2.278765 -2.217963
H 4.860474 2.868182 -0.394069


