%chk=000091931.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091931

0 1
 N  -0.3173000      0.1002000     -0.3019000    
 N   -1.421400     -0.4619000     -0.1677000    
 N   0.7973000      -2.455400       1.564900    
 C    2.099400     -0.1495000     -0.7595000    
 C    2.575300      0.8489000      0.3242000    
 C   0.7546000     -0.8718000     -0.5361000    
 C   -2.490800      0.5074000      6.5200001E-02
 C    1.487500       1.906900      0.5483000    
 C    3.892100       1.545600     -1.6700000E-02
 C   0.3748000      -1.676800      -1.784100    
 C   -2.555400       1.452000      -1.134400    
 C   -3.800700     -0.2663000      0.2118000    
 C   -2.174100       1.276900       1.347200    
 C   0.7787000      -1.756100      0.6388000    
 H    2.890100     -0.9014000     -0.8925000    
 H    2.044600      0.3981000      -1.711500    
 H    2.727700      0.3051000       1.264900    
 H    1.031900       2.254600     -0.3840000    
 H   0.7351000       1.538700       1.246900    
 H    1.912500       2.791400       1.038900    
 H    4.684200      0.8078000     -0.1817000    
 H    3.797000       2.148100     -0.9263000    
 H    4.212600       2.203900      0.7977000    
 H    1.176300      -2.374900      -2.055100    
 H  -0.5298000      -2.281800      -1.646100    
 H   0.2030000      -1.018200      -2.643800    
 H   -2.687900      0.8951000      -2.069500    
 H   -3.397800       2.146400      -1.037600    
 H   -1.648900       2.058400      -1.241700    
 H   -3.752200     -0.9667000       1.053500    
 H   -4.013700     -0.8554000     -0.6876000    
 H   -4.646500      0.4087000      0.3816000    
 H   -1.365300       1.999200       1.210800    
 H   -3.046900       1.853000       1.676400    
 H   -1.894600      0.6017000       2.164000    


%chk=000091931-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091931

0 1
N -0.466745 -0.020982 -0.711945
N -1.298476 -0.151666 0.253137
N 1.022423 -2.196563 1.728209
C 2.023938 -0.053140 -0.917226
C 2.628615 0.777775 0.245224
C 0.762134 -0.924667 -0.613084
C -2.556473 0.692175 0.139253
C 1.644646 1.813126 0.840631
C 3.913796 1.478496 -0.259819
C 0.555175 -1.971508 -1.747225
C -2.613367 1.601924 -1.104376
C -3.710053 -0.346055 0.136755
C -2.585605 1.518966 1.450893
C 0.888874 -1.625324 0.689378
H 2.807334 -0.732326 -1.306962
H 1.734212 0.622952 -1.746608
H 2.915571 0.074867 1.054224
H 1.237912 2.472655 0.049821
H 0.797413 1.328922 1.355737
H 2.164862 2.449473 1.580323
H 4.642590 0.750783 -0.664124
H 3.675982 2.203711 -1.062120
H 4.407074 2.032863 0.559420
H 1.423316 -2.649844 -1.801377
H -0.353852 -2.569706 -1.567058
H 0.450302 -1.442879 -2.710452
H -2.559726 1.013430 -2.036535
H -3.561444 2.169383 -1.097532
H -1.773566 2.318466 -1.114400
H -3.613562 -1.035642 0.993082
H -3.703746 -0.941462 -0.793945
H -4.680745 0.176416 0.209989
H -1.765842 2.259532 1.467690
H -3.545841 2.059402 1.530170
H -2.475724 0.858344 2.328152


