%chk=000102629.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102629

0 1
 O  -7.9899997E-02 -0.3490000       1.920300    
 N    3.480100      -1.666200     -2.0000000E-02
 C  -0.1437000     -0.3064000      0.4792000    
 C    1.005800      -1.290200      4.1999999E-03
 C    2.406800     -0.8069000      0.4757000    
 C   0.1019000       1.146700      2.6300000E-02
 C   -1.561700     -0.7110000      2.5500000E-02
 C   0.7817000      -2.733400      0.5104000    
 C  -0.2365000       2.175900      0.8657000    
 C   0.6560000       1.333100      -1.215100    
 C   -1.844500     -0.6817000      -1.314600    
 C   -2.467000      -1.078700      0.9857000    
 C    4.775300      -1.210000      0.4843000    
 C    3.482000      -1.691400      -1.482500    
 C  -5.5999998E-03   3.482500      0.4355000    
 C  -0.8392000       1.952300       2.213800    
 C   0.8871000       2.639700      -1.645400    
 C   -3.126700      -1.047200      -1.724800    
 C   -3.749200      -1.444200      0.5756000    
 C   0.5562000       3.714400     -0.8200000    
 C   -4.078900      -1.428300     -0.7796000    
 H   0.9598000      -1.351800      -1.086500    
 H    2.598900      0.2274000      0.1732000    
 H    2.427200     -0.8158000       1.573400    
 H    1.456700      -3.433400      6.0000001E-03
 H   0.9643000      -2.830000       1.585300    
 H  -0.2341000      -3.081400      0.3016000    
 H  -0.1831000      -1.263000       2.228700    
 H   0.9259000      0.5356000      -1.895100    
 H   -1.123300     -0.4236000      -2.078900    
 H   -2.261900      -1.107100       2.048900    
 H    4.786500      -1.216000       1.580000    
 H    5.020700     -0.1981000      0.1419000    
 H    5.574500      -1.886500      0.1612000    
 H    3.481500     -0.6859000      -1.919000    
 H    2.641400      -2.260900      -1.888900    
 H    4.375000      -2.210600      -1.851800    
 H  -0.2553000       4.331900       1.065900    
 H   -1.711900       1.297000       2.197100    
 H  -9.1700003E-02   1.650400       2.954100    
 H   -1.239100       2.902100       2.595600    
 H    1.323700       2.820900      -2.623200    
 H   -3.381700      -1.042300      -2.780600    
 H   -4.491400      -1.741400       1.310900    
 H   0.7364000       4.731700      -1.155100    
 H   -5.076700      -1.714600      -1.099000    


%chk=000102629-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000102629

0 1
O 0.139588 -0.228779 2.046453
N 3.480191 -1.756359 -0.264792
C -0.030952 -0.241974 0.573526
C 1.011911 -1.276579 -0.004522
C 2.463166 -0.929093 0.434948
C 0.170520 1.218324 0.090222
C -1.466953 -0.695852 0.191544
C 0.686762 -2.735918 0.396823
C -0.422239 2.330688 0.775435
C 0.875969 1.467737 -1.115912
C -1.865633 -0.712830 -1.170474
C -2.394264 -1.120732 1.173036
C 4.749823 -1.835317 0.487602
C 3.705510 -1.340324 -1.663910
C -0.242926 3.631023 0.233841
C -1.251171 2.209200 2.043496
C 1.034218 2.766710 -1.642926
C -3.151080 -1.160651 -1.542228
C -3.683746 -1.569285 0.803593
C 0.475786 3.864381 -0.957278
C -4.067407 -1.595696 -0.555483
H 0.943789 -1.236956 -1.108074
H 2.658965 0.160770 0.301894
H 2.552675 -1.129983 1.518752
H 1.508294 -3.379706 0.038424
H 0.634783 -2.873830 1.498179
H -0.266780 -3.086123 -0.032271
H 0.181928 -1.173057 2.347757
H 1.323486 0.636312 -1.668358
H -1.176735 -0.355786 -1.944825
H -2.111506 -1.083608 2.230391
H 4.559688 -2.240681 1.497220
H 5.263553 -0.847070 0.603335
H 5.446199 -2.519990 -0.030050
H 4.095593 -0.293865 -1.752671
H 2.767581 -1.406009 -2.243305
H 4.435907 -2.019944 -2.138422
H -0.693195 4.479038 0.764175
H -2.066778 1.475157 1.923005
H -0.637501 1.857506 2.888151
H -1.698736 3.184885 2.302024
H 1.590183 2.913543 -2.575592
H -3.440711 -1.164064 -2.599302
H -4.388240 -1.892250 1.578809
H 0.589390 4.883462 -1.343718
H -5.066605 -1.941829 -0.842624


