%chk=000249373.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249373

0 1
S -0.360207 2.084839 1.360985
C 4.655984 -1.078023 -0.056312
C 3.394199 -0.284663 0.296428
C 4.924892 -0.998868 -1.572591
C 4.415123 -2.542652 0.360214
C 5.898551 -0.537120 0.676320
C 2.259929 -0.377590 -0.529423
C 3.318596 0.506934 1.452633
C 1.088273 0.318654 -0.224938
C 2.148371 1.201927 1.773209
C 1.043339 1.106535 0.925460
C -1.657904 1.257736 0.747042
C -3.823332 0.071191 -0.153268
C -5.009030 0.809743 -0.328236
C -3.797871 -1.302531 -0.460207
C -2.655367 0.710745 0.332147
C -6.156084 0.173444 -0.806453
C -4.951609 -1.925642 -0.939717
C -6.129745 -1.191316 -1.113106
H 5.860089 -1.503610 -1.836286
H 4.128958 -1.472139 -2.156935
H 5.005737 0.041480 -1.906393
H 3.554465 -2.974312 -0.161246
H 5.284316 -3.168647 0.135474
H 4.217760 -2.623566 1.434749
H 6.798952 -1.087949 0.383092
H 6.072347 0.518889 0.442491
H 5.807033 -0.631574 1.763473
H 2.289450 -0.998720 -1.424872
H 4.173091 0.585629 2.124364
H 0.223497 0.240968 -0.884293
H 2.110436 1.805242 2.680622
H -5.026633 1.872328 -0.089695
H -2.880813 -1.872906 -0.320731
H -7.074539 0.743361 -0.941345
H -4.933483 -2.988319 -1.178009
H -7.026768 -1.682297 -1.486347


%chk=000249373-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249373

0 1
S -0.430530 2.017808 1.738713
C 4.701023 -1.068836 -0.086729
C 3.434257 -0.308928 0.373615
C 4.897785 -0.860040 -1.619104
C 4.528332 -2.590070 0.207099
C 5.979582 -0.576318 0.638559
C 2.167802 -0.635696 -0.184789
C 3.467335 0.724716 1.344549
C 0.986768 0.032134 0.198694
C 2.294611 1.404710 1.744659
C 1.057249 1.054081 1.166710
C -1.742816 1.200387 0.960927
C -3.898069 0.062875 -0.137976
C -5.015265 0.856059 -0.536304
C -3.950831 -1.349173 -0.336779
C -2.744276 0.674037 0.452934
C -6.150612 0.249766 -1.111169
C -5.086123 -1.944823 -0.922725
C -6.191629 -1.150803 -1.310430
H 5.794275 -1.407153 -1.966974
H 4.030760 -1.229019 -2.195630
H 5.031070 0.211307 -1.856044
H 3.650330 -3.010721 -0.315012
H 5.422454 -3.147178 -0.130783
H 4.396097 -2.769352 1.289803
H 6.852990 -1.150557 0.279246
H 6.178224 0.493059 0.438696
H 5.912237 -0.720995 1.732811
H 2.091934 -1.426579 -0.940136
H 4.415008 1.014764 1.807090
H 0.024636 -0.236367 -0.250377
H 2.354844 2.195793 2.500909
H -4.979317 1.940499 -0.388842
H -3.100215 -1.964558 -0.024898
H -7.003315 0.870002 -1.408949
H -5.112422 -3.029983 -1.071876
H -7.074180 -1.617647 -1.761188


