%chk=000099702.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099702

0 1
 O    1.359200       1.499900      0.6991000    
 N    2.989900      0.1319000     -0.2245000    
 C   5.3300001E-02 -0.5468000      0.2801000    
 C    1.094600      -1.400100     -0.5335000    
 C   0.2536000     -0.8382000       1.825400    
 C    2.560500      -1.257900     -8.9000002E-02
 C   -1.410300     -0.7837000     -0.1409000    
 C    4.364200      0.2924000      0.2508000    
 C    2.877000      0.5700000      -1.615700    
 C   0.5148000      0.9036000      3.6400001E-02
 C  -0.5455000      9.2600003E-02   2.753500    
 C  -2.4000000E-02  -2.290100       2.244200    
 C   -2.332400      0.2437000     -7.9599999E-02
 C   -1.709700      -2.057200     -0.5667000    
 C    4.808100       1.736800      4.2100001E-02
 C    4.465500     -0.1054000       1.720600    
 C    3.803900     -0.2695000      -2.489200    
 C    1.430200      0.4610000      -2.089000    
 C   -3.660200     -3.8300000E-02 -0.4801000    
 C   -3.015300      -2.334300     -0.9610000    
 C   -2.007300       1.537800      0.3584000    
 C   -3.985400      -1.332400     -0.9185000    
 C   -4.623800      0.9823000     -0.4310000    
 C   -2.977500       2.539600      0.4011000    
 C   -4.283300       2.262300      7.1999999E-03
 H   0.9152000      -2.434800     -0.2048000    
 H   0.9503000      -1.637000      -1.595300    
 H    1.293300     -0.6336000       2.102300    
 H    2.630000      -1.611800      0.9416000    
 H    3.186100      -1.966600     -0.6440000    
 H    5.075200     -0.3636000     -0.2638000    
 H    3.142200       1.626400      -1.728800    
 H   2.3000001E-03   1.482400     -0.7509000    
 H  -0.3277000     -0.1575000       3.799800    
 H  -0.2660000       1.142300       2.646700    
 H   -1.625700     -2.4300000E-02   2.634500    
 H   -1.071400      -2.567500       2.094500    
 H   0.6100000      -3.012800       1.727000    
 H   0.1848000      -2.417800       3.313300    
 H   -1.005800      -2.877900     -0.6005000    
 H    5.048600       1.966800      -1.000500    
 H    5.730200       1.933700      0.6026000    
 H    4.062700       2.454200      0.4041000    
 H    5.429300      0.2108000       2.137100    
 H    3.684500      0.3693000       2.325300    
 H    4.418100      -1.188400       1.871000    
 H    4.864800     -0.1912000      -2.241500    
 H    3.744600      0.1048000      -3.520800    
 H    3.529800      -1.326400      -2.554500    
 H    1.147500       1.505500      -2.324000    
 H    1.540600      8.7800004E-02  -3.126300    
 H   0.4709000     -7.3000002E-03  -1.936000    
 H   -3.282000      -3.332200      -1.297300    
 H   -1.119600       1.872800      0.8609000    
 H   -5.000000      -1.571900      -1.230100    
 H   -5.651000      0.7876000     -0.7322000    
 H   -2.726300       3.527100      0.7784000    
 H   -5.040200       3.040100      4.9400002E-02


%chk=000099702-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099702

0 1
O 1.276448 1.356182 1.648679
N 3.135143 0.060829 -0.565676
C 0.145372 -0.646546 0.701414
C 1.182979 -1.485215 -0.166035
C 0.116751 -1.196825 2.192222
C 2.676692 -1.179967 0.094083
C -1.256627 -0.713016 0.022681
C 4.276384 0.829539 0.060615
C 3.253662 0.037898 -2.069795
C 0.722156 0.788906 0.668266
C -0.803101 -0.388190 3.141298
C -0.257688 -2.695928 2.303261
C -2.247114 0.357365 0.066215
C -1.606335 -1.894612 -0.657162
C 4.046986 2.348637 -0.148913
C 4.498947 0.551205 1.563667
C 3.608419 -1.349326 -2.668512
C 2.036428 0.667665 -2.795721
C -3.516954 0.176498 -0.627897
C -2.859902 -2.076033 -1.310348
C -2.067172 1.606012 0.760524
C -3.800042 -1.050112 -1.308191
C -4.496425 1.226302 -0.623616
C -3.037728 2.608870 0.748831
C -4.267427 2.427065 0.044940
H 1.020644 -2.560337 0.029970
H 0.958072 -1.326656 -1.233212
H 1.152280 -1.070277 2.570520
H 2.830154 -1.069360 1.178599
H 3.266190 -2.076669 -0.212299
H 5.223014 0.547296 -0.465316
H 4.115009 0.695825 -2.302176
H 0.603447 1.315959 -0.305148
H -0.747964 -0.819117 4.158505
H -0.491512 0.665891 3.211974
H -1.858438 -0.430826 2.817266
H -1.280919 -2.883669 1.930083
H 0.435486 -3.364740 1.762523
H -0.231421 -2.997263 3.366834
H -0.894128 -2.722332 -0.700561
H 3.886852 2.596967 -1.213808
H 4.924039 2.924126 0.203404
H 3.157161 2.665846 0.422068
H 5.313507 1.208042 1.919813
H 3.595410 0.785252 2.152203
H 4.808230 -0.490894 1.762866
H 4.522624 -1.768496 -2.209045
H 3.793071 -1.242214 -3.753218
H 2.791411 -2.082852 -2.543313
H 1.804978 1.656285 -2.362843
H 2.263547 0.803500 -3.870800
H 1.128819 0.042906 -2.723484
H -3.068175 -3.024139 -1.817944
H -1.157924 1.785632 1.334870
H -4.763700 -1.165067 -1.818375
H -5.438286 1.059150 -1.160299
H -2.854616 3.542340 1.292124
H -5.021311 3.221688 0.040789


