%chk=000215407.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215407

0 1
S 3.760345 2.263495 1.954973
O -2.998508 -2.524463 -3.030503
N 2.348834 1.975639 -1.656354
C -0.815219 1.580492 -0.889431
C 0.293869 2.374934 -0.183556
C -1.847682 1.096868 0.092970
C -1.951621 -0.258805 0.456697
C 1.321948 2.942457 -1.176728
C -1.057834 -1.294273 -0.114784
C -2.735636 2.025412 0.663650
C -2.924385 -0.662943 1.386422
C -1.340531 -1.894875 -1.356140
C 3.588776 1.935404 -0.832745
C -3.701768 1.617078 1.583278
C 0.076271 -1.694361 0.607956
C -3.796390 0.269479 1.948401
C -0.481171 -2.880386 -1.860349
C -2.546907 -1.478215 -2.158042
C 3.447404 1.321251 0.514775
C 0.918366 -2.688512 0.104118
C 0.641021 -3.280608 -1.132157
C 3.095374 0.052366 0.862267
C 3.074379 -0.169022 2.291949
C 3.412526 0.928833 3.019285
H -0.368194 0.733330 -1.449633
H -1.302150 2.212251 -1.661626
H -0.150965 3.205901 0.397883
H 0.794376 1.731548 0.568371
H 0.806032 3.312345 -2.094366
H 1.817265 3.831948 -0.731344
H -2.666297 3.075932 0.384430
H 1.942133 1.035355 -1.719840
H -2.993278 -1.713387 1.667989
H 4.003164 2.969468 -0.770361
H 4.343379 1.355512 -1.425304
H -4.382425 2.347448 2.017846
H 0.296847 -1.222447 1.565740
H -4.547456 -0.049805 2.668033
H -0.700913 -3.330089 -2.831656
H -2.296831 -0.661148 -2.866389
H -3.391759 -1.159673 -1.517152
H 1.789336 -3.004473 0.675884
H 1.299187 -4.052067 -1.528187
H 2.849016 -0.735866 0.163094
H 2.813672 -1.132713 2.708454
H 3.479358 1.035498 4.087229
H -3.262855 -3.309115 -2.507447


%chk=000215407-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215407

0 1
S 3.615919 2.365492 1.807885
O -2.581475 -2.150957 -3.372912
N 2.193787 2.089895 -1.775319
C -0.810660 1.548020 -0.827786
C 0.193221 2.556746 -0.203398
C -1.852983 1.044003 0.165276
C -1.932648 -0.324157 0.571634
C 1.230753 3.074719 -1.241446
C -1.049980 -1.401074 0.004704
C -2.752413 1.977208 0.746492
C -2.875346 -0.697463 1.569766
C -1.137808 -1.825681 -1.356854
C 3.460667 1.864419 -1.048621
C -3.698640 1.592523 1.718303
C -0.131305 -2.057020 0.867195
C -3.754221 0.244883 2.142332
C -0.291702 -2.866476 -1.818793
C -2.152333 -1.214467 -2.321889
C 3.372680 1.291393 0.361626
C 0.703170 -3.095029 0.399823
C 0.628061 -3.497513 -0.953374
C 3.078557 -0.001841 0.773818
C 3.030160 -0.173310 2.206745
C 3.293296 0.989097 2.913485
H -0.242846 0.693116 -1.237529
H -1.316049 2.045405 -1.682669
H -0.362762 3.429110 0.195801
H 0.711518 2.085291 0.651318
H 0.675502 3.515778 -2.096356
H 1.818202 3.896882 -0.788956
H -2.703000 3.026148 0.428900
H 1.756173 1.221327 -2.101799
H -2.924719 -1.747982 1.879152
H 4.013503 2.822778 -1.020606
H 4.067723 1.172917 -1.664024
H -4.383011 2.334887 2.144107
H -0.068409 -1.729900 1.911319
H -4.478596 -0.068932 2.902030
H -0.374832 -3.177564 -2.865918
H -1.711683 -0.375480 -2.889309
H -3.023532 -0.818737 -1.762112
H 1.404418 -3.585182 1.084852
H 1.273358 -4.299628 -1.329100
H 2.884618 -0.815557 0.068678
H 2.815426 -1.128342 2.693550
H 3.330219 1.148941 3.989551
H -2.987873 -2.945687 -2.941971


