%chk=000116356.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000116356

0 1
S 1.628036 -0.527690 0.259923
N -0.613809 2.748883 -0.648205
N 3.885424 -1.576015 1.153706
N 4.061958 0.470580 -0.166143
C -0.110117 1.510697 0.008122
C -1.193205 0.445637 -0.043954
C 1.202177 1.001432 -0.616465
C -1.838580 0.066382 1.142134
C -1.567927 -0.150843 -1.257106
C -2.841650 -0.906669 1.114891
C -2.572185 -1.122581 -1.279780
C -3.209951 -1.503204 -0.094898
C 3.413919 -0.499406 0.374719
H 0.091880 1.792132 1.082535
H 2.017486 1.751077 -0.517730
H 1.110896 0.790237 -1.696754
H -1.562199 0.531742 2.087512
H -1.077605 0.135179 -2.184867
H -0.973877 2.565299 -1.578913
H 0.119622 3.446069 -0.731215
H -3.338349 -1.197838 2.038901
H -2.858113 -1.583797 -2.223402
H -3.991347 -2.259855 -0.114663
H 4.837781 -1.879731 1.007302
H 3.258885 -2.342142 1.361808
H 5.073451 0.524024 -0.108658


%chk=000116356-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000116356

0 1
S 1.999708 -1.027882 -0.605089
N -0.234387 2.539312 -0.570688
N 4.058592 -1.389986 1.081426
N 3.568982 0.930879 0.527942
C 0.156353 1.157237 -0.204068
C -1.100845 0.288488 -0.128378
C 1.243263 0.613247 -1.169864
C -1.672905 -0.029822 1.127448
C -1.748697 -0.174465 -1.302836
C -2.857607 -0.794304 1.213926
C -2.937689 -0.934258 -1.223370
C -3.496151 -1.248634 0.036712
C 3.367592 -0.356579 0.455215
H 0.617691 1.200869 0.799883
H 2.097203 1.312651 -1.193733
H 0.863575 0.431356 -2.189459
H -1.183997 0.327884 2.041378
H -1.324017 0.047147 -2.290106
H -0.868869 2.610185 -1.371313
H 0.541461 3.207826 -0.600418
H -3.282097 -1.034855 2.195373
H -3.424028 -1.284998 -2.140962
H -4.415089 -1.842408 0.100686
H 4.852892 -1.185825 1.684401
H 3.778620 -2.361483 0.956876
H 4.353047 1.228018 1.137819


