%chk=000055849.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055849

0 1
 N    3.103800       1.346300     -0.3174000    
 N   -5.548900     -0.1974000      0.3160000    
 C   0.7998000       1.136100      0.7092000    
 C    2.288200      0.6869000      0.7036000    
 C   9.8800004E-02  0.2887000     -0.3977000    
 C   0.6269000       2.649400      0.5583000    
 C    2.114600     -0.7690000      0.3562000    
 C   0.8861000     -0.9971000     -0.2848000    
 C    1.552700       3.240800     -0.4968000    
 C    2.993300       2.799100     -0.2656000    
 C   -1.396500      0.1601000     -0.2087000    
 C    3.021800      -1.798900      0.5530000    
 C   0.5614000      -2.258300     -0.7626000    
 C   -2.265000      0.5625000      -1.223300    
 C   -1.907400     -0.3609000      0.9804000    
 C    2.687200      -3.074400      9.5399998E-02
 C    1.467900      -3.301500     -0.5606000    
 C   -3.644000      0.4441000      -1.049100    
 C   -3.286200     -0.4793000       1.154500    
 C   -4.154600     -7.6899998E-02  0.1399000    
 H   0.3863000      0.8682000       1.693100    
 H    2.731200      0.8067000       1.698900    
 H   0.3138000      0.7139000      -1.387100    
 H   0.8603000       3.121300       1.521800    
 H  -0.4142000       2.904900      0.3328000    
 H    1.222300       2.939400      -1.498300    
 H    1.494000       4.334700     -0.4619000    
 H    2.805400       1.039900      -1.244300    
 H    3.636200       3.231800      -1.039900    
 H    3.363800       3.172000      0.6967000    
 H    3.973900      -1.622000       1.041900    
 H  -0.3734000      -2.442200      -1.281600    
 H   -1.881900      0.9706000      -2.154800    
 H   -1.252900     -0.6934000       1.781200    
 H    3.381500      -3.898000      0.2381000    
 H    1.230000      -4.299100     -0.9199000    
 H   -4.310300      0.7613000      -1.847300    
 H   -3.671800     -0.8895000       2.084400    
 H   -6.179100      9.5100001E-02 -0.4189000    
 H   -5.919500     -0.5742000       1.178300    


%chk=000055849-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000055849

0 1
N 3.186468 1.360417 -0.241950
N -5.641573 -0.153319 0.351058
C 0.776033 1.187696 0.686573
C 2.274054 0.707236 0.745697
C 0.093740 0.259513 -0.388541
C 0.614815 2.708298 0.461646
C 2.147605 -0.771882 0.407397
C 0.917281 -1.025758 -0.252722
C 1.564619 3.262325 -0.628197
C 3.023633 2.832199 -0.326234
C -1.412185 0.120833 -0.215029
C 3.087630 -1.801869 0.605628
C 0.609840 -2.323412 -0.709130
C -2.316200 0.770533 -1.091824
C -1.967155 -0.627660 0.857206
C 2.778625 -3.107749 0.150890
C 1.547213 -3.365159 -0.501034
C -3.712714 0.689622 -0.915048
C -3.357420 -0.722778 1.049267
C -4.258967 -0.061327 0.164032
H 0.311815 0.923468 1.659403
H 2.696095 0.889558 1.753943
H 0.277395 0.687879 -1.398114
H 0.834139 3.235329 1.413358
H -0.441713 2.933744 0.216211
H 1.275410 2.881633 -1.629548
H 1.487876 4.366897 -0.668575
H 3.102561 0.914489 -1.167343
H 3.718742 3.214585 -1.096586
H 3.338497 3.268869 0.643819
H 4.041990 -1.594578 1.102473
H -0.345362 -2.524141 -1.207617
H -1.920551 1.351284 -1.935541
H -1.295885 -1.153681 1.547545
H 3.493004 -3.924711 0.304759
H 1.318845 -4.380371 -0.846221
H -4.384755 1.204318 -1.613287
H -3.755603 -1.312468 1.884904
H -6.284794 0.314455 -0.280019
H -6.027548 -0.692617 1.119851


