%chk=000154406.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154406

0 1
 O   -6.654400     -0.1748000     -0.1408000    
 N   -1.074400     -6.8599999E-02 -5.0999999E-02
 N    1.802800     -1.2600000E-02 -8.7000001E-03
 N    7.432600      9.5899999E-02  7.0699997E-02
 C  -0.2943000      -1.293600     -0.2246000    
 C  -0.3480000       1.185900      0.1450000    
 C    1.064600      -1.180500      0.4719000    
 C    1.034200       1.126100     -0.5112000    
 C   -2.466400     -9.5500000E-02 -7.2499998E-02
 C    3.194800      1.4100000E-02  1.0900000E-02
 C   -3.172000      -1.054600     -0.8360000    
 C   -3.232300      0.8359000      0.6669000    
 C    3.931200     -0.6977000      0.9868000    
 C    3.930500      0.7541000     -0.9444000    
 C    5.325800     -0.6708000       1.006600    
 C    5.325000      0.7808000     -0.9248000    
 C   -4.566500      -1.080800     -0.8592000    
 C   -4.626700      0.8097000      0.6439000    
 C    6.022700      6.8499997E-02  5.0900001E-02
 C   -5.293800     -0.1486000     -0.1192000    
 C   -7.335300      0.8073000      0.6388000    
 H  -0.1508000      -1.482000      -1.295800    
 H  -0.8197000      -2.156700      0.2025000    
 H  -0.2437000       1.379000       1.219900    
 H  -0.8937000       2.028100     -0.2980000    
 H   0.9230000      -1.097400       1.556700    
 H    1.621300      -2.104700      0.2740000    
 H   0.9279000       1.038400      -1.599600    
 H    1.548600       2.071000     -0.2973000    
 H   -2.637600      -1.788200      -1.435400    
 H   -2.744400       1.588400       1.282800    
 H    3.420500      -1.274000       1.755100    
 H    3.420000       1.310700      -1.727100    
 H    5.858100      -1.227800       1.773500    
 H    5.857000       1.358200      -1.676700    
 H   -5.080900      -1.827900      -1.457500    
 H   -5.129400       1.560500       1.244100    
 H    7.938300      0.6324000     -0.6216000    
 H    7.939100     -0.4197000      0.7781000    
 H   -7.125600      0.6891000       1.707300    
 H   -8.408900      0.6399000      0.5035000    
 H   -7.122700       1.821400      0.2837000    


%chk=000154406-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154406

0 1
O -6.753894 -0.295161 -0.029247
N -1.075802 -0.060617 -0.031121
N 1.836076 -0.009719 -0.008116
N 7.541585 0.081789 0.032892
C -0.284699 -1.285488 -0.236102
C -0.331875 1.190807 0.183918
C 1.088137 -1.184721 0.459459
C 1.054929 1.137726 -0.489490
C -2.481742 -0.087565 -0.018546
C 3.247377 0.013640 0.002050
C -3.204883 -1.221344 -0.510273
C -3.244062 1.008781 0.481863
C 4.002008 -0.938698 0.750264
C 3.981965 0.989675 -0.735570
C 5.410492 -0.919919 0.753866
C 5.390300 1.015832 -0.718704
C -4.608878 -1.252048 -0.491429
C -4.656806 0.982084 0.489973
C 6.137230 0.059686 0.022882
C -5.348416 -0.152587 0.006281
C -7.544136 0.819583 0.487257
H -0.133405 -1.502984 -1.317159
H -0.823937 -2.146785 0.202313
H -0.205062 1.415057 1.267162
H -0.895277 2.032085 -0.263868
H 0.937712 -1.172150 1.563322
H 1.658585 -2.102474 0.217115
H 0.922568 1.118797 -1.595591
H 1.588903 2.075172 -0.239732
H -2.669645 -2.075475 -0.936117
H -2.739673 1.886284 0.898052
H 3.490627 -1.690200 1.360332
H 3.455983 1.724343 -1.353687
H 5.953555 -1.669248 1.344057
H 5.917722 1.781891 -1.301567
H -5.154900 -2.120421 -0.873676
H -5.197612 1.846428 0.888495
H 8.054090 0.785013 -0.489080
H 8.068411 -0.605768 0.561453
H -7.331284 1.006397 1.559152
H -8.593855 0.512002 0.367933
H -7.361914 1.749201 -0.088817


