%chk=000276656.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276656

0 1
S -5.748967 -0.423815 -0.856124
S -3.430388 -1.693047 -2.171659
O -3.622055 1.739221 1.526417
O 5.473948 -0.857081 -1.076172
N -3.312964 0.149601 -0.179496
N 4.447980 0.225055 0.685890
N -1.954073 0.187326 0.070095
C 0.365460 -0.037559 -0.404882
C 3.083152 0.114238 0.281701
C -5.578818 0.763969 0.495498
C -4.110551 0.986116 0.735725
C 1.346465 -0.605203 -1.240030
C 0.762051 0.607462 0.781067
C 2.695196 -0.534117 -0.905814
C 2.107790 0.687647 1.127216
C -1.049518 -0.138625 -0.810353
C -4.005510 -0.655516 -1.076120
C 5.574050 -0.271142 -0.019488
C 6.881095 0.002477 0.669920
H -6.073973 0.387611 1.417714
H -6.085998 1.721890 0.247496
H 1.053461 -1.112546 -2.161468
H 0.004812 1.050238 1.436704
H 3.448745 -0.981632 -1.564700
H 2.393465 1.191432 2.047484
H -1.210524 -0.488603 -1.844255
H 4.606937 0.711170 1.571432
H 7.079675 1.075737 0.791015
H 7.711283 -0.407699 0.068186
H 6.944975 -0.470605 1.659004


%chk=000276656-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276656

0 1
S -5.766981 -0.772438 -0.703651
S -3.203203 -2.393988 -1.194259
O -3.775835 2.239530 0.970671
O 5.550165 -0.477945 -1.387254
N -3.354401 0.144634 -0.051360
N 4.497114 0.101531 0.631821
N -1.985592 0.240413 0.346909
C 0.332744 -0.019482 -0.263863
C 3.124353 0.046538 0.281680
C -5.668870 0.907508 0.148430
C -4.198132 1.201534 0.421996
C 1.283423 -0.325027 -1.274951
C 0.803101 0.320778 1.037851
C 2.666420 -0.296726 -1.020332
C 2.176430 0.353842 1.304049
C -1.094178 -0.050640 -0.585371
C -3.947844 -0.987984 -0.645067
C 5.622635 -0.148689 -0.170176
C 6.948561 0.012694 0.571684
H -6.225162 0.875153 1.098298
H -6.094475 1.686585 -0.502597
H 0.934129 -0.593103 -2.279513
H 0.072704 0.556892 1.817472
H 3.393098 -0.532541 -1.798736
H 2.528594 0.619520 2.309308
H -1.371490 -0.298986 -1.620672
H 4.690400 0.359662 1.603185
H 7.072450 1.042770 0.954577
H 7.769111 -0.204790 -0.126467
H 7.017931 -0.683245 1.428342


