%chk=000084604.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084604

0 1
 O   -6.868500      -2.030500     -3.6400001E-02
 N   -3.954200      0.2126000      0.2140000    
 N    6.011000      -1.489600      0.2566000    
 C   -1.223700       1.155900     -0.2858000    
 C   0.1322000       1.612200      0.2458000    
 C    3.748800      0.3079000     -0.2655000    
 C   -2.343100       2.090100      0.1860000    
 C   -1.530800     -0.2811000      0.1492000    
 C    1.255900      0.7075000     -0.2525000    
 C    2.615400       1.186900      0.2556000    
 C   -3.716300       1.582700     -0.2594000    
 C   -2.930700     -0.7098000     -0.2956000    
 C    5.111200      0.8203000      0.2187000    
 C    3.556300      -1.152100      0.1640000    
 C    6.238300     -0.1196000     -0.2085000    
 C    4.745100      -2.014300     -0.2603000    
 C   -5.289800     -0.2389000     -0.1755000    
 C   -5.557200      -1.640300      0.3498000    
 H   -1.196700       1.185700      -1.384000    
 H   0.1254000       1.622300       1.343100    
 H   0.3221000       2.642600     -7.9700001E-02
 H    3.743700      0.3463000      -1.363700    
 H   -2.181900       3.098500     -0.2135000    
 H   -2.325100       2.175200       1.280600    
 H   -1.445800     -0.3742000       1.239900    
 H  -0.8237000     -0.9893000     -0.2946000    
 H    1.083100     -0.3028000      0.1212000    
 H    1.254500      0.6711000      -1.348200    
 H    2.616200       1.194700       1.353000    
 H    2.780400       2.222100     -6.8599999E-02
 H   -4.477900       2.255600      0.1532000    
 H   -3.791400       1.637700      -1.353500    
 H   -2.969700     -0.7785000      -1.390700    
 H   -3.050300      -1.719000      0.1072000    
 H    5.110100      0.9118000       1.312900    
 H    5.299700       1.822400     -0.1843000    
 H    2.663400      -1.587300     -0.2958000    
 H    3.428100      -1.213700       1.252400    
 H    6.348900     -0.1065000      -1.299800    
 H    7.183200      0.2420000      0.2118000    
 H    4.604000      -3.031100      0.1226000    
 H    4.788200      -2.088600      -1.354000    
 H   -5.423000     -0.2218000      -1.265700    
 H   -6.052100      0.4366000      0.2340000    
 H    6.776100      -2.083900     -6.1299998E-02
 H   -5.490900      -1.676300       1.442200    
 H   -4.896500      -2.396700     -7.7799998E-02
 H   -7.021800      -2.919400      0.3271000    


%chk=000084604-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000084604

0 1
O -7.423533 -1.593419 0.059467
N -4.105566 0.138211 0.036323
N 6.411041 -1.217972 0.152775
C -1.262094 0.947471 -0.262139
C 0.113671 1.330838 0.338232
C 3.904523 0.261934 -0.217728
C -2.370204 1.917758 0.218245
C -1.688300 -0.502306 0.076242
C 1.307465 0.509154 -0.200067
C 2.666088 0.999150 0.351568
C -3.752937 1.530712 -0.340488
C -3.092733 -0.819755 -0.475110
C 5.218560 0.942497 0.248478
C 3.938089 -1.241029 0.167862
C 6.461970 0.196310 -0.279677
C 5.217156 -1.928031 -0.356291
C -5.488089 -0.229599 -0.353996
C -6.070095 -1.307407 0.570762
H -1.190779 1.031113 -1.370465
H 0.066149 1.228341 1.443449
H 0.301029 2.406841 0.135087
H 3.864877 0.326442 -1.329365
H -2.127795 2.955077 -0.087582
H -2.415467 1.897379 1.325570
H -1.695746 -0.630013 1.177441
H -0.967774 -1.231384 -0.341313
H 1.166817 -0.558228 0.057602
H 1.320793 0.566697 -1.309412
H 2.668278 0.903757 1.458502
H 2.767585 2.083901 0.134116
H -4.528427 2.207243 0.064719
H -3.745692 1.662110 -1.456085
H -3.058930 -0.798464 -1.598359
H -3.387763 -1.843793 -0.181022
H 5.253192 0.947761 1.356056
H 5.242644 1.996239 -0.094472
H 3.052341 -1.768191 -0.235428
H 3.912652 -1.331176 1.272248
H 6.490032 0.300438 -1.396374
H 7.383868 0.657496 0.121129
H 5.254256 -2.978157 -0.011077
H 5.175540 -1.943077 -1.477504
H -5.554302 -0.586804 -1.410517
H -6.131898 0.665376 -0.275191
H 7.284068 -1.722545 -0.047399
H -6.099398 -0.920293 1.609610
H -5.443053 -2.223736 0.552250
H -7.861909 -2.259467 0.645526


