%chk=000156043.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156043

0 1
 S   -3.132200      -1.712200     -3.6100000E-02
 N   -1.367000      0.4226000      5.5799998E-02
 N  -0.5700000      -1.851400      7.1000000E-03
 C   -2.445300       1.418100      7.1300000E-02
 C  -3.3199999E-02  0.9310000      1.7000000E-03
 C   -3.811200      0.8553000      0.4328000    
 C    1.032000      1.3000000E-03  6.6999998E-03
 C   -1.526800     -0.9662000      1.1700000E-02
 C   -4.178200     -0.3116000     -0.4543000    
 C   0.7526000      -1.374700      2.6500000E-02
 C    2.380800      0.4371000     -1.3200000E-02
 C   0.2879000       2.298500     -5.7599999E-02
 C    2.656000       1.808000     -5.5300001E-02
 C    1.800200      -2.302500      4.3600000E-02
 C    1.615500       2.730600     -8.3600000E-02
 C    3.414500     -0.5110000      6.0000001E-03
 C    3.124400      -1.873000      3.6800001E-02
 H   -2.504900       1.897100     -0.9146000    
 H   -2.236100       2.198100      0.8137000    
 H   -3.839300      0.5692000       1.492500    
 H   -4.557900       1.649400      0.3091000    
 H   -5.221500     -0.5984000     -0.2909000    
 H   -4.061600     -6.2399998E-02  -1.514100    
 H  -0.4796000       3.066500     -8.9199997E-02
 H    3.681500       2.170100     -7.3600002E-02
 H    1.586900      -3.368700      5.8300000E-02
 H    1.836300       3.793600     -0.1256000    
 H    4.456000     -0.1963000     -5.5000000E-03
 H    3.931200      -2.599900      4.9800001E-02


%chk=000156043-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156043

0 1
S -3.181562 -1.753478 -0.340404
N -1.356573 0.412814 -0.047549
N -0.555560 -1.863360 -0.107960
C -2.452060 1.411014 0.076015
C -0.016213 0.932696 -0.085198
C -3.806222 0.838235 0.514688
C 1.067136 -0.011756 -0.026333
C -1.526893 -0.979370 -0.137818
C -4.312922 -0.241875 -0.443710
C 0.779716 -1.423011 -0.001273
C 2.432869 0.450535 0.004893
C 0.259533 2.310709 -0.158428
C 2.681889 1.863484 -0.050006
C 1.829709 -2.353291 0.087519
C 1.615647 2.758801 -0.138889
C 3.478553 -0.525923 0.091244
C 3.175061 -1.893969 0.138175
H -2.563863 1.943820 -0.891527
H -2.125424 2.156845 0.824739
H -3.738069 0.425031 1.537875
H -4.524265 1.680398 0.546313
H -5.308541 -0.616217 -0.156193
H -4.345282 0.113352 -1.487135
H -0.535384 3.054136 -0.245538
H 3.715370 2.226098 -0.026234
H 1.587842 -3.419471 0.104032
H 1.810143 3.835666 -0.195122
H 4.520047 -0.186255 0.117729
H 3.986319 -2.627457 0.205892


