%chk=000215612.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215612

0 1
S 0.775408 2.625173 -0.823379
S 2.976037 -0.411392 1.283225
O 0.744113 0.155509 -1.919222
N -2.916305 -1.001677 -0.140317
C -0.436190 -1.015015 -0.192158
C -1.714540 -0.310307 -0.709015
C 0.812834 -0.124451 -0.500445
C -4.149888 -0.741466 -0.956095
C -3.253632 -0.511202 1.238555
C -4.922265 0.429497 -0.307706
C -4.349294 0.572228 1.114222
C -0.303712 -2.403994 -0.814507
C 0.728007 1.206570 0.188329
C 2.111720 -0.799514 -0.179075
C 0.594065 1.554195 1.497603
C 2.803910 -1.729985 -0.896865
C 0.556238 2.986952 1.696525
C 4.032957 -2.146110 -0.260718
C 0.651725 3.699529 0.541162
C 4.261684 -1.528801 0.930274
H -0.495959 -1.122812 0.919340
H -1.691234 0.774059 -0.471545
H -1.732000 -0.377629 -1.819799
H -4.751574 -1.674762 -0.922180
H -3.914021 -0.549462 -2.017716
H -2.363178 -0.140017 1.776219
H -3.632482 -1.389492 1.802701
H -6.004967 0.229487 -0.289498
H -4.785192 1.359866 -0.882871
H -3.928711 1.579191 1.270140
H -5.129377 0.436844 1.879542
H -1.251778 -2.953751 -0.711193
H -0.079011 -2.341230 -1.885731
H 0.475676 -3.000166 -0.330740
H 1.632810 0.346773 -2.288212
H 0.518667 0.865787 2.328595
H 2.484924 -2.140306 -1.846998
H 0.462268 3.415709 2.684970
H 4.683121 -2.882038 -0.714734
H 0.650693 4.767230 0.410644
H 5.090554 -1.656020 1.604574


%chk=000215612-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215612

0 1
S 0.847874 2.774199 -0.760513
S 2.995484 -0.532276 1.361017
O 0.714797 0.083090 -1.998881
N -2.929050 -1.043318 -0.043077
C -0.427858 -1.034250 -0.171254
C -1.749429 -0.402919 -0.692312
C 0.794486 -0.107383 -0.527897
C -4.193683 -0.916251 -0.822232
C -3.280538 -0.432528 1.275397
C -4.770401 0.495424 -0.481701
C -4.297170 0.738539 0.988406
C -0.281937 -2.476754 -0.691503
C 0.656960 1.241161 0.182230
C 2.141852 -0.759562 -0.220890
C 0.432442 1.517854 1.523612
C 2.873079 -1.603361 -1.048917
C 0.417442 2.926655 1.839268
C 4.100322 -2.086977 -0.464739
C 0.629491 3.737736 0.737701
C 4.314178 -1.623590 0.822368
H -0.475042 -1.066298 0.936443
H -1.726530 0.699690 -0.540282
H -1.808765 -0.578358 -1.780768
H -4.897469 -1.699919 -0.477742
H -4.008265 -1.075025 -1.897770
H -2.371076 -0.083859 1.794088
H -3.760097 -1.201622 1.910075
H -5.868891 0.536849 -0.587073
H -4.337423 1.253612 -1.159196
H -3.816488 1.726582 1.095380
H -5.142487 0.702646 1.698651
H -1.236886 -3.000514 -0.511015
H -0.077654 -2.479226 -1.777224
H 0.526842 -3.026564 -0.180990
H 1.590923 0.430089 -2.313003
H 0.291266 0.738230 2.276978
H 2.523298 -1.886238 -2.044141
H 0.252333 3.316976 2.846581
H 4.793125 -2.754971 -0.982375
H 0.657326 4.824186 0.675750
H 5.145717 -1.818757 1.497452


