%chk=000282252.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282252

0 1
S -0.224538 -1.330475 1.956359
O -1.025272 -2.529188 1.842070
O 0.103639 -0.834163 3.275790
O 2.522601 3.675866 0.579461
N 1.534171 1.035075 0.078820
C 0.639889 -0.158830 0.036761
C 1.210168 -1.342985 0.899692
C -0.699659 0.020720 0.895666
C 0.341576 -0.537544 -1.424814
C 1.451464 -2.685675 0.229339
C 1.596482 -0.793430 -2.269996
C 2.577964 -2.647023 -0.813357
C -1.986492 -0.007156 0.152580
C 2.083127 -2.245578 -2.207704
C 0.956226 2.230138 -0.621978
C 1.993308 1.445596 1.447434
C 2.046400 3.308152 -0.730200
C 3.056124 2.546230 1.298817
C -2.488771 1.213652 -0.341864
C -2.710042 -1.184860 -0.085141
C -3.686263 1.249832 -1.056952
C -3.910585 -1.141375 -0.800629
C -4.402158 0.070904 -1.290769
H 2.155649 -1.042596 1.411983
H -0.660663 0.981377 1.467801
H -0.261965 0.266718 -1.896563
H -0.315333 -1.431993 -1.445457
H 1.709075 -3.432269 1.011726
H 0.519264 -3.068994 -0.239012
H 2.414960 -0.114560 -1.949983
H 1.379843 -0.529538 -3.323592
H 3.054067 -3.645748 -0.870934
H 3.374854 -1.950389 -0.486281
H 2.905363 -2.383181 -2.938208
H 1.277107 -2.930901 -2.534793
H 2.444991 0.566336 1.962784
H 1.162699 1.809174 2.092980
H 0.067576 2.643040 -0.094343
H 0.622361 1.933783 -1.640833
H 3.329906 2.991420 2.272035
H 3.956274 2.179015 0.775078
H 2.900289 2.967787 -1.342311
H 1.651324 4.263493 -1.117786
H -1.942928 2.138453 -0.162182
H -2.361484 -2.152072 0.297999
H -4.066050 2.199451 -1.431164
H -4.465667 -2.063666 -0.971898
H -5.336972 0.099382 -1.846128


%chk=000282252-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000282252

0 1
S -0.288307 -1.318144 2.068941
O -1.177186 -2.686245 1.911053
O 0.091844 -0.749178 3.559156
O 2.735757 3.703777 0.486073
N 1.550483 1.065818 0.077224
C 0.640697 -0.124252 -0.017022
C 1.263308 -1.303817 0.825584
C -0.760918 0.143256 0.737723
C 0.413030 -0.527856 -1.497140
C 1.498734 -2.689694 0.236097
C 1.703448 -0.799707 -2.316294
C 2.639480 -2.718455 -0.820314
C -2.105574 0.055729 0.103334
C 2.206905 -2.259860 -2.230965
C 1.230972 2.206643 -0.824900
C 1.819660 1.609541 1.441744
C 2.414347 3.192443 -0.852749
C 3.016425 2.573189 1.384993
C -2.899415 1.237381 0.045572
C -2.644054 -1.151483 -0.427380
C -4.173282 1.227519 -0.558980
C -3.923728 -1.161183 -1.019314
C -4.689181 0.025866 -1.097535
H 2.127698 -0.984102 1.427288
H -0.678700 1.050739 1.359558
H -0.196731 0.253017 -1.986179
H -0.222703 -1.430708 -1.515898
H 1.768895 -3.358630 1.075890
H 0.569718 -3.106671 -0.195222
H 2.505180 -0.111536 -1.986180
H 1.498151 -0.569053 -3.380137
H 3.016403 -3.757558 -0.886297
H 3.487883 -2.097728 -0.468156
H 3.066539 -2.380760 -2.919943
H 1.410534 -2.939300 -2.599952
H 2.030522 0.803958 2.164336
H 0.947538 2.181251 1.840791
H 0.309391 2.746118 -0.494271
H 1.064873 1.846804 -1.852553
H 3.205325 3.022377 2.373743
H 3.922363 2.030514 1.038735
H 3.302889 2.679875 -1.282272
H 2.170418 4.081321 -1.458023
H -2.507840 2.168995 0.473437
H -2.087674 -2.088500 -0.325200
H -4.765361 2.148220 -0.600574
H -4.332249 -2.100242 -1.408294
H -5.682606 0.011717 -1.559226


