%chk=000152797.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152797

0 1
 O    5.809400      0.9965000     -0.2800000    
 N    5.030600     -0.1368000     -0.1692000    
 N  -0.5059000      0.1624000      0.6035000    
 N   -1.090400      0.2062000     -0.5045000    
 C    3.636400     -6.1799999E-02  2.7000001E-02
 C   -4.610300     -0.8124000     -3.7599999E-02
 C   0.8842000      8.6999997E-02  0.4109000    
 C    3.013500       1.181500      0.1362000    
 C    2.879600      -1.230500      0.1104000    
 C   -2.473600      0.2811000     -0.3124000    
 C    1.634000       1.256200      0.3286000    
 C    1.500100      -1.156000      0.3027000    
 C   -3.230700     -0.8874000     -0.2291000    
 C   -5.232800      0.4313000      7.0500001E-02
 C   -3.096100       1.524700     -0.2044000    
 C   -4.475800       1.599800     -1.2900000E-02
 C   -5.420200      -2.061500      5.1700000E-02
 C    5.747900      -1.380300     -0.2915000    
 H    3.579100       2.107400      7.5099997E-02
 H    3.325900      -2.217200      2.9800000E-02
 H    1.156600       2.228800      0.4132000    
 H   0.9175000      -2.071200      0.3669000    
 H   -2.742900      -1.856000     -0.3124000    
 H   -6.306700      0.5030000      0.2217000    
 H   -2.514900       2.441000     -0.2688000    
 H   -4.960300       2.568100      7.1500003E-02
 H   -4.989600      -2.855600     -0.5678000    
 H   -5.462000      -2.408600       1.088800    
 H   -6.442800      -1.897000     -0.3043000    
 H    6.820800      -1.203000     -0.4290000    
 H    5.402800      -1.951600      -1.159900    
 H    5.637700      -1.991200      0.6109000    
 H    5.815800       1.144300      -1.241400    


%chk=000152797-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152797

0 1
O 5.504088 -0.203944 -1.927173
N 5.172175 -0.534609 -0.522755
N -0.353196 -0.186595 0.768173
N -1.230389 -0.266101 -0.205968
C 3.793425 -0.378222 -0.239113
C -4.945525 -0.235138 -0.540189
C 1.006282 -0.255355 0.353585
C 2.822497 -0.448187 -1.286454
C 3.347633 -0.227691 1.108811
C -2.596725 -0.196597 0.223276
C 1.455482 -0.386961 -0.994476
C 1.973215 -0.174507 1.390918
C -3.558570 -0.287128 -0.816375
C -5.354475 -0.079850 0.809811
C -3.022153 -0.045393 1.573853
C -4.399111 0.011980 1.853503
C -5.968494 -0.365004 -1.656146
C 6.195615 0.038738 0.371125
H 3.167284 -0.522241 -2.320348
H 4.064263 -0.157499 1.931474
H 0.706549 -0.433238 -1.791057
H 1.616766 -0.062737 2.420348
H -3.191825 -0.398639 -1.843474
H -6.424511 -0.028935 1.046334
H -2.266332 0.025601 2.361525
H -4.740747 0.133225 2.888078
H -5.593046 0.064264 -2.601684
H -6.210037 -1.428058 -1.851188
H -6.913667 0.145104 -1.399678
H 7.187153 -0.184402 -0.050627
H 6.125686 -0.445974 1.359138
H 6.089832 1.135808 0.492372
H 5.777761 -1.080515 -2.311419


