%chk=000150617.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150617

1 1
 S    2.398900       1.365900      7.5400002E-02
 S   -2.182300       1.213900      4.9100000E-02
 N    3.489100     -0.8723000     -0.2277000    
 N   -3.593400     -0.9820000     -0.2525000    
 N   -1.162100      -1.205500     -0.2785000    
 N  -8.3700001E-02 -0.3360000     -0.1582000    
 C    4.541100      7.6000001E-03 -0.1078000    
 C   -4.535900      5.2400000E-02 -0.1135000    
 C    3.668800      -2.294100     -0.4210000    
 C    4.125400       1.321300      7.0299998E-02
 C    2.321200     -0.3117000     -0.1521000    
 C   -4.042500      -2.347900     -0.4414000    
 C   -3.959200       1.323500      6.0699999E-02
 C   -2.272600     -0.5572000     -0.1923000    
 C    5.904400     -0.3171000     -0.1512000    
 C   -5.923200     -5.8200002E-02 -0.1312000    
 C    5.053500       2.362400      0.2121000    
 C    3.731000      -2.982600      0.9278000    
 C   -4.723700       2.470500      0.2153000    
 C   -4.218600      -3.062100      0.8828000    
 C    1.035100     -0.9808000     -0.2440000    
 C    6.833600      0.7181000     -1.0200000E-02
 C    6.413600       2.036000      0.1685000    
 C   -6.707200       1.090300      2.3800001E-02
 C   -6.111300       2.345900      0.1959000    
 H    2.871000      -2.716100      -1.039600    
 H    4.583900      -2.491600     -0.9887000    
 H   -4.955300      -2.410700      -1.043700    
 H   -3.286300      -2.891000      -1.022700    
 H    6.265800      -1.331800     -0.2796000    
 H   -6.425200      -1.012200     -0.2531000    
 H    4.734800       3.390400      0.3517000    
 H    4.558800      -2.599600       1.533000    
 H    3.876200      -4.059400      0.7974000    
 H    2.807100      -2.831100       1.494900    
 H   -4.263700       3.444100      0.3488000    
 H   -4.517100      -4.102200      0.7182000    
 H   -4.987300      -2.581500       1.496300    
 H   -3.286400      -3.063100       1.457600    
 H    1.022200      -2.075300     -0.3785000    
 H    7.896300      0.4919000     -3.8199998E-02
 H    7.154500       2.824100      0.2764000    
 H   -7.790800       1.007400      1.2600000E-02
 H   -6.735800       3.226800      0.3152000    


%chk=000150617-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150617

1 1
S 2.350769 1.371875 0.087914
S -2.325051 1.535989 0.049707
N 3.541021 -0.967706 -0.276359
N -3.594545 -0.795289 -0.229714
N -1.233386 -1.070369 -0.252288
N -0.068820 -0.370207 -0.169209
C 4.617867 -0.054060 -0.117021
C -4.634767 0.159311 -0.108251
C 3.769244 -2.429428 -0.479250
C 4.169008 1.280082 0.081303
C 2.292438 -0.408706 -0.178881
C -3.848533 -2.259340 -0.369979
C -4.146172 1.485942 0.046197
C -2.325492 -0.278757 -0.161376
C 6.000236 -0.348835 -0.142977
C -6.024873 -0.095059 -0.138142
C 5.072525 2.343773 0.247070
C 3.862379 -3.197573 0.853397
C -5.021413 2.578351 0.171861
C -4.150538 -2.927980 0.984953
C 1.052794 -1.101691 -0.265593
C 6.907659 0.716017 0.024098
C 6.453413 2.047653 0.215241
C -6.903137 0.999788 -0.013100
C -6.410970 2.322316 0.140622
H 2.953793 -2.819060 -1.110260
H 4.697159 -2.534775 -1.065189
H -4.687085 -2.380473 -1.077783
H -2.946518 -2.696309 -0.824593
H 6.369151 -1.368768 -0.281749
H -6.416685 -1.109460 -0.252798
H 4.724022 3.369564 0.396734
H 4.685413 -2.816979 1.482090
H 4.053900 -4.265200 0.649140
H 2.924285 -3.121644 1.429722
H -4.643868 3.598224 0.288860
H -4.350790 -4.001775 0.824615
H -5.033759 -2.486158 1.477357
H -3.288530 -2.838425 1.667510
H 1.015412 -2.191628 -0.397538
H 7.982087 0.510123 0.007627
H 7.179942 2.855694 0.341918
H -7.983079 0.825023 -0.033991
H -7.113804 3.155327 0.236209


