%chk=000151322.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151322

0 1
 O  -7.4299999E-02  -2.503500       1.704100    
 O  -0.6900000      -2.342300     -0.3968000    
 N   0.1865000      0.2813000      0.6949000    
 N   -7.170500      0.4968000     -6.3999998E-03
 N   0.1920000      -2.351300      0.4909000    
 C   -2.220400      0.3414000      0.4930000    
 C   -3.393100      0.4331000     -0.4840000    
 C  -0.8825000      0.3798000     -0.2391000    
 C   -4.734100      0.4337000      0.2532000    
 C    1.552300      0.2626000      0.2933000    
 C    2.213300     -0.9436000      6.8000001E-03
 C    2.211300       1.499300      0.1952000    
 C   -5.903600      0.4882000     -0.7282000    
 C    3.568900     -0.9120000     -0.3882000    
 C    3.566800       1.530900     -0.1995000    
 C    4.227900      0.3249000     -0.4861000    
 C    1.555100      -2.180700      0.1045000    
 C    1.551000       2.705800      0.4814000    
 C    4.229100      -2.118400     -0.6747000    
 C    4.225100       2.768000     -0.2973000    
 C    2.225300      -3.369700     -0.1836000    
 C    3.560600      -3.338700     -0.5729000    
 C    2.219300       3.926000      0.3796000    
 C   -7.543700     -0.8605000      0.3958000    
 C   -8.227100       1.091800     -0.8265000    
 C    3.554700       3.957100     -9.3000000E-03
 H   -2.303900     -0.5818000       1.078900    
 H   -2.273400       1.171400       1.209500    
 H   -3.355500     -0.4143000      -1.179500    
 H   -3.303800       1.347800      -1.082600    
 H  -0.8195000       1.364800     -0.7225000    
 H  -0.8282000     -0.3068000      -1.084400    
 H   -4.777100       1.295000      0.9320000    
 H   -4.788300     -0.4675000      0.8743000    
 H   3.8899999E-02  0.7184000       1.601200    
 H   -5.851600     -0.3338000      -1.453900    
 H   -5.794000       1.416900      -1.304500    
 H    5.274200      0.3493000     -0.7908000    
 H   0.5114000       2.744200      0.7957000    
 H    5.273300      -2.117800     -0.9808000    
 H    5.269300       2.816100     -0.5995000    
 H    1.723200      -4.332100     -0.1106000    
 H    4.083400      -4.263800     -0.7975000    
 H    1.697700       4.851500      0.6054000    
 H   -8.490900     -0.8454000      0.9475000    
 H   -6.806600      -1.299400       1.074900    
 H   -7.664100      -1.530100     -0.4639000    
 H   -8.384700      0.5399000      -1.760300    
 H   -9.174200       1.116600     -0.2759000    
 H   -7.985000       2.131300      -1.074600    
 H    4.075900       4.906600     -8.8500001E-02


%chk=000151322-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151322

0 1
O -0.174898 -1.162257 1.838476
O -1.191589 -2.518368 0.302789
N 0.197930 1.181034 0.333594
N -7.305140 0.081493 -0.221839
N -0.185594 -1.799683 0.714467
C -2.274182 0.769904 0.230597
C -3.447222 0.323662 -0.669610
C -0.936818 0.802787 -0.536690
C -4.806093 0.373711 0.064504
C 1.520474 0.774473 0.208784
C 1.886402 -0.569992 -0.166641
C 2.575279 1.745945 0.449567
C -5.963998 -0.127826 -0.822252
C 3.252039 -0.818945 -0.632857
C 3.950820 1.417876 0.110509
C 4.247449 0.172756 -0.494935
C 1.026227 -1.736291 -0.133189
C 2.314760 3.053873 0.985371
C 3.583559 -2.085973 -1.233106
C 4.985709 2.391280 0.344883
C 1.371795 -2.954716 -0.722928
C 2.654362 -3.116735 -1.327122
C 3.340596 3.973311 1.209883
C -7.525884 -0.715471 1.002658
C -8.383613 -0.134892 -1.208088
C 4.695765 3.638664 0.888300
H -2.177523 0.085705 1.093583
H -2.488293 1.780613 0.640112
H -3.254349 -0.710712 -1.020787
H -3.494636 0.967325 -1.573805
H -1.012074 1.533367 -1.373537
H -0.742923 -0.174618 -1.004295
H -5.032497 1.411968 0.378174
H -4.732260 -0.236153 0.985856
H 0.038754 2.050897 0.842550
H -5.789964 -1.208625 -1.075488
H -5.942488 0.431557 -1.778776
H 5.263079 -0.028670 -0.853599
H 1.295872 3.362343 1.245670
H 4.604665 -2.225484 -1.606783
H 6.017370 2.123056 0.088409
H 0.670052 -3.790119 -0.651320
H 2.917916 -4.071758 -1.791300
H 3.109210 4.957460 1.631006
H -8.531671 -0.497989 1.404645
H -6.788870 -0.444594 1.776637
H -7.453921 -1.820335 0.826429
H -8.436637 -1.187904 -1.589087
H -9.360061 0.109845 -0.752165
H -8.234281 0.533313 -2.075330
H 5.493794 4.366895 1.067777


