%chk=000030522.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030522

0 1
 O   -1.556200      6.3600004E-02   2.144800    
 N    2.529900      0.7130000      0.6799000    
 C    2.677400       1.059600     -0.7467000    
 C    4.836500     -2.5800001E-02  0.1368000    
 C    3.701800     -2.8400000E-02   1.181700    
 C    3.034900     -0.1734000      -1.599700    
 C    3.845700       2.064600     -0.8293000    
 C    4.343300     -0.7978000      -1.098400    
 C    5.127700       1.426900     -0.2737000    
 C    1.277300      3.5900000E-02  0.9884000    
 C   3.2000002E-02  0.8231000      0.5073000    
 C    1.213500     -0.1756000       2.502400    
 C   -1.358300      0.1395000      0.7226000    
 C   -2.552200      0.9483000      0.1846000    
 C   -1.352700      -1.269300      0.1106000    
 C   -3.817200      0.4701000      0.4143000    
 C   -1.257900      -1.387900      -1.254200    
 C   -2.295400       2.109400     -0.4990000    
 C   -1.442300      -2.348600      0.9550000    
 C   -4.899300       1.203100     -7.3100001E-02
 C   -1.252600      -2.667100      -1.810100    
 C   -3.377600       2.842500     -0.9862000    
 C   -1.436800      -3.627800      0.3989000    
 C   -4.679600       2.389200     -0.7732000    
 C   -1.341900      -3.787000     -0.9836000    
 H    1.819800       1.582000      -1.172400    
 H    5.737600     -0.4957000      0.5452000    
 H    3.478200      -1.081200       1.398800    
 H    4.053600      0.4413000       2.107600    
 H    3.151900      0.1205000      -2.650100    
 H    2.228900     -0.9155000      -1.579000    
 H    3.610700       2.977700     -0.2681000    
 H    4.007700       2.371300      -1.870000    
 H    4.178200      -1.852600     -0.8484000    
 H    5.100100     -0.7760000      -1.891500    
 H    5.922300       1.462500      -1.028100    
 H    5.484300       2.000100      0.5904000    
 H    1.282100     -0.9528000      0.5149000    
 H   4.2300001E-02   1.806100      0.9994000    
 H   0.1231000      0.9834000     -0.5686000    
 H    2.117900     -0.6008000       2.946300    
 H   0.4386000     -0.8964000       2.772900    
 H    1.014000      0.7647000       3.029500    
 H   -1.641100      0.9696000       2.488900    
 H   -4.003700     -0.4477000      0.9625000    
 H   -1.184800     -0.5277000      -1.911500    
 H   -1.310200       2.513100     -0.6910000    
 H   -1.519400      -2.264600       2.033000    
 H   -5.913100      0.8510000      9.3699999E-02
 H   -1.177700      -2.791200      -2.886400    
 H   -3.207600       3.766900      -1.530600    
 H   -1.506600      -4.500300       1.042000    
 H   -5.522100       2.960300      -1.152100    
 H   -1.337400      -4.783100      -1.416500    


%chk=000030522-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000030522

0 1
O -1.738340 -0.051650 2.242185
N 2.534428 0.683905 0.681380
C 2.672452 1.034292 -0.770305
C 4.841994 -0.067790 0.037062
C 3.730653 -0.124126 1.113797
C 2.958722 -0.217490 -1.653468
C 3.840619 2.044809 -0.903576
C 4.344609 -0.812233 -1.232685
C 5.139662 1.412249 -0.308307
C 1.253957 0.048237 1.152635
C 0.013570 0.840756 0.664231
C 1.289098 -0.031566 2.697766
C -1.377460 0.147201 0.809640
C -2.512914 0.991504 0.173789
C -1.346204 -1.261840 0.187169
C -3.835344 0.475001 0.247078
C -1.198949 -1.400050 -1.216673
C -2.315688 2.254261 -0.437658
C -1.439878 -2.426609 0.985339
C -4.926371 1.195936 -0.277285
C -1.133788 -2.678591 -1.810772
C -3.410184 2.980785 -0.965277
C -1.379871 -3.708031 0.389876
C -4.717976 2.456112 -0.888996
C -1.221993 -3.840795 -1.008108
H 1.750210 1.531762 -1.112108
H 5.749306 -0.559953 0.437420
H 3.449622 -1.195399 1.263118
H 4.113859 0.252401 2.082923
H 2.952070 0.066268 -2.723484
H 2.149387 -0.959952 -1.513832
H 3.575548 2.973398 -0.367978
H 3.974770 2.299763 -1.972936
H 4.260121 -1.895353 -1.022285
H 5.089928 -0.696777 -2.042842
H 5.980180 1.472624 -1.025547
H 5.452503 1.950512 0.605979
H 1.178245 -0.995469 0.754748
H -0.004911 1.823025 1.179068
H 0.126748 1.048693 -0.413825
H 2.139848 -0.635993 3.055205
H 0.358417 -0.483373 3.074234
H 1.393612 0.986279 3.119098
H -1.867075 0.844877 2.643465
H -3.994214 -0.499539 0.721111
H -1.153292 -0.505409 -1.850092
H -1.313955 2.688377 -0.510615
H -1.565964 -2.317100 2.065476
H -5.937536 0.778325 -0.212941
H -1.022668 -2.768806 -2.897391
H -3.237112 3.955607 -1.435453
H -1.455952 -4.601930 1.019751
H -5.564047 3.018222 -1.300043
H -1.174855 -4.834355 -1.468159


