%chk=000237000.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237000

0 1
S 6.081600 -0.572296 0.612947
S 7.369089 -0.023967 -2.062993
N 8.679935 -0.571265 0.163342
C -2.906833 0.016688 -0.478307
C -4.180476 -0.123744 0.366300
C -1.646151 -0.220555 0.364129
C -5.441057 0.113629 -0.476252
C -0.372937 -0.080201 -0.481084
C -6.714874 -0.026831 0.368105
C 0.887848 -0.317201 0.361297
C -7.975511 0.210421 -0.474420
C 2.159332 -0.176511 -0.485776
C -9.249107 0.069957 0.369868
C 3.421662 -0.413910 0.359443
C -10.510973 0.307204 -0.471775
C 4.668978 -0.269592 -0.500718
C -11.781865 0.168585 0.363580
C 7.495319 -0.390195 -0.444690
C 9.938733 -0.447037 -0.608742
C 8.792372 -0.897026 1.602267
H -2.935070 -0.698206 -1.323218
H -2.868965 1.023497 -0.937271
H -4.152658 0.591236 1.211068
H -4.218831 -1.130588 0.824989
H -1.684581 -1.227375 0.822940
H -1.618322 0.494673 1.208726
H -5.469103 -0.601187 -1.321177
H -5.402993 1.120464 -0.935035
H -0.401617 -0.795303 -1.325968
H -0.335508 0.926571 -0.940466
H -6.687204 0.688106 1.212903
H -6.753240 -1.033627 0.826876
H 0.849214 -1.324149 0.820192
H 0.915436 0.398479 1.205726
H -7.937277 1.217233 -0.933189
H -8.003307 -0.504511 -1.319229
H 2.196987 0.830585 -0.945402
H 2.130937 -0.892241 -1.330667
H -9.222811 0.784224 1.215064
H -9.288886 -0.936388 0.829121
H 3.373774 -1.423255 0.818237
H 3.440154 0.305144 1.204535
H -10.473413 1.314765 -0.930229
H -10.539550 -0.408284 -1.316778
H 4.753125 0.739117 -0.953828
H 4.686821 -0.993525 -1.340655
H -11.869420 -0.831962 0.802025
H -12.676562 0.339397 -0.245352
H -11.803444 0.890114 1.188155
H 10.022292 0.563189 -1.058775
H 9.955903 -1.173602 -1.446521
H 10.818618 -0.622432 0.026215
H 8.279172 -1.850134 1.836310
H 8.346338 -0.099045 2.227455
H 9.846113 -1.005534 1.907101


%chk=000237000-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237000

0 1
S 6.267839 -0.519750 0.747897
S 7.412510 -0.297494 -2.166906
N 8.889032 -0.616289 0.102700
C -2.937985 0.088103 -0.439424
C -4.244457 -0.124934 0.357708
C -1.664205 -0.208506 0.383538
C -5.520111 0.177711 -0.460180
C -0.356602 -0.018133 -0.417496
C -6.825599 -0.047843 0.335212
C 0.914434 -0.297501 0.415596
C -8.102399 0.255336 -0.480950
C 2.221993 -0.144610 -0.394123
C -9.407701 0.024365 0.313257
C 3.486953 -0.387711 0.464759
C -10.684680 0.324872 -0.504411
C 4.767576 -0.285040 -0.380796
C -11.983933 0.092101 0.296756
C 7.653113 -0.480914 -0.483988
C 10.089742 -0.609875 -0.762744
C 9.048747 -0.765564 1.566483
H -2.950121 -0.559071 -1.341611
H -2.900257 1.134327 -0.809125
H -4.229942 0.517198 1.263526
H -4.283512 -1.173156 0.721885
H -1.710015 -1.249903 0.765937
H -1.645593 0.449347 1.277929
H -5.531213 -0.458890 -1.369891
H -5.485624 1.228311 -0.817752
H -0.369483 -0.687439 -1.303282
H -0.315683 1.018489 -0.812663
H -6.814153 0.587291 1.245974
H -6.859935 -1.099010 0.691287
H 0.860618 -1.324933 0.832476
H 0.938941 0.390712 1.286489
H -8.070121 1.307455 -0.834427
H -8.112301 -0.377683 -1.393226
H 2.265560 0.872658 -0.834848
H 2.210620 -0.854889 -1.246545
H -9.400583 0.658393 1.224880
H -9.440606 -1.027355 0.667952
H 3.426344 -1.389500 0.934347
H 3.514959 0.352408 1.289302
H -10.650673 1.375290 -0.859532
H -10.691445 -0.309781 -1.414324
H 4.876902 0.698675 -0.865870
H 4.825889 -1.062075 -1.160316
H -12.054229 -0.957249 0.640837
H -12.881197 0.308885 -0.311951
H -12.018782 0.740465 1.192825
H 10.150150 0.334645 -1.332541
H 10.040590 -1.432817 -1.498154
H 10.985287 -0.724896 -0.131797
H 8.533212 -1.673388 1.932208
H 8.629895 0.107301 2.101520
H 10.119439 -0.846543 1.805992


