%chk=000287476.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287476

0 1
S 2.835300 0.088164 2.097713
C 0.174872 -2.867329 -0.607490
C 1.268995 -2.591422 -1.647568
C -1.153124 -2.208513 -1.003442
C 2.640410 -3.133534 -1.219030
C -2.252622 -2.496381 0.027716
C 3.246532 -2.383517 -0.024171
C -3.562362 -1.784196 -0.336427
C 3.616821 -0.936608 -0.375467
C -4.663935 -2.006938 0.709711
C 4.115263 -0.137759 0.818206
C -4.441456 -1.204513 1.990153
C 1.444616 0.771254 1.258852
C 0.375869 2.301414 -0.284652
C 1.556108 1.773708 0.331269
C -0.892645 1.781247 0.084246
C 0.177734 0.242833 1.641017
C -0.963959 0.741042 1.066280
C 0.444872 3.342934 -1.264079
C -2.069860 2.308199 -0.535069
C -0.701071 3.830373 -1.841155
C -1.974696 3.306015 -1.472853
H 0.038496 -3.957732 -0.483079
H 0.499938 -2.486316 0.382361
H 0.984224 -3.041409 -2.617834
H 1.342084 -1.499974 -1.830037
H -1.469796 -2.563399 -2.002216
H -1.009651 -1.113325 -1.101601
H 2.551563 -4.207720 -0.963456
H 3.334212 -3.088580 -2.080717
H -2.425269 -3.586874 0.102657
H -1.917673 -2.176357 1.033454
H 4.141112 -2.924744 0.337356
H 2.525942 -2.395553 0.820353
H -3.378732 -0.699962 -0.465077
H -3.916922 -2.144556 -1.321931
H 4.398351 -0.936496 -1.163903
H 2.738347 -0.434648 -0.837470
H -4.738107 -3.085132 0.953347
H -5.643234 -1.732318 0.269576
H 4.946499 -0.657883 1.337373
H 4.502511 0.848127 0.502164
H -5.237592 -1.393723 2.719044
H -3.490913 -1.467069 2.468889
H -4.425993 -0.126904 1.794019
H 2.521584 2.189902 0.048066
H 0.128925 -0.556098 2.382185
H -1.943643 0.346272 1.339612
H 1.421355 3.738967 -1.537963
H -3.038371 1.902321 -0.245945
H -0.657858 4.623117 -2.586419
H -2.865351 3.713190 -1.948569


%chk=000287476-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000287476

0 1
S 2.874075 -0.037376 2.108122
C 0.328815 -2.955211 -0.598702
C 1.402530 -3.070568 -1.705243
C -1.070880 -2.607523 -1.154649
C 2.811322 -3.474062 -1.196289
C -2.136194 -2.414363 -0.051630
C 3.397006 -2.558251 -0.090796
C -3.525333 -2.037137 -0.617520
C 3.524855 -1.076748 -0.508748
C -4.637929 -1.900873 0.451326
C 4.038923 -0.157248 0.614215
C -4.407583 -0.742708 1.449380
C 1.414949 0.853018 1.440442
C 0.214632 2.273160 -0.172846
C 1.406680 1.603993 0.261847
C -0.989262 2.177115 0.627238
C 0.221453 0.757642 2.235617
C -0.944635 1.408062 1.838229
C 0.178239 3.042239 -1.383888
C -2.177844 2.845285 0.187617
C -0.994737 3.685649 -1.787500
C -2.184229 3.586840 -0.997170
H 0.278075 -3.909178 -0.032387
H 0.623705 -2.174750 0.131460
H 1.070894 -3.820295 -2.453132
H 1.460153 -2.106095 -2.250719
H -1.401163 -3.404941 -1.853640
H -1.000742 -1.676274 -1.755546
H 2.765248 -4.509650 -0.800954
H 3.509606 -3.500382 -2.058834
H -2.224536 -3.347160 0.544946
H -1.785611 -1.626147 0.644592
H 4.398382 -2.939810 0.198345
H 2.767592 -2.619276 0.817447
H -3.440630 -1.082108 -1.177678
H -3.829563 -2.807077 -1.357120
H 4.228754 -0.995253 -1.364653
H 2.549600 -0.701445 -0.869554
H -4.725758 -2.855626 1.009716
H -5.609878 -1.747188 -0.059568
H 4.968831 -0.550499 1.063194
H 4.241645 0.868380 0.259695
H -5.258899 -0.641416 2.147880
H -3.494849 -0.904292 2.051236
H -4.290007 0.217607 0.910793
H 2.307819 1.705041 -0.352968
H 0.237056 0.163709 3.156183
H -1.849523 1.328915 2.452707
H 1.087802 3.120269 -1.991911
H -3.085317 2.769313 0.799182
H -1.008949 4.270563 -2.713912
H -3.096889 4.095726 -1.325853


