%chk=000180834.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180834

0 1
S 5.035594 0.377599 -1.058578
F 5.647628 -1.398038 0.755470
F 4.997705 0.439935 1.553545
F 7.844351 -0.158037 1.796711
F 7.965586 0.005812 -0.302737
F 0.890301 -2.477858 -1.122844
F -5.319786 -1.494935 2.228489
F -5.808442 1.468881 -1.370846
O 5.530597 -0.578733 -2.010339
O 5.336568 1.785842 -1.174027
O -1.451478 1.663016 0.480840
O -4.056234 1.585528 1.581761
N -0.814959 -0.446471 -0.272851
N -3.102445 0.049406 0.123831
C 3.349332 0.146679 -0.817750
C 5.779756 -0.068609 0.573764
C 2.780223 -1.108572 -1.070758
C 2.543709 1.211297 -0.399309
C 7.225328 0.431702 0.748012
C 0.570624 -0.209453 -0.441437
C 1.414412 -1.271816 -0.878848
C 1.173068 1.040760 -0.208762
C -1.758768 0.544231 0.155630
C -5.495298 0.028071 0.453621
C -4.197489 0.678427 0.811830
C -6.037704 -1.017118 1.217653
C -6.284322 0.488212 -0.612283
C -7.285496 -1.585396 0.952890
C -7.538214 -0.047685 -0.916434
C -8.032765 -1.085397 -0.119431
H 3.397348 -1.946370 -1.424483
H 2.987044 2.201158 -0.221962
H 7.306455 1.544892 0.838907
H 0.565427 1.893300 0.129304
H -1.139836 -1.404589 -0.429612
H -3.313407 -0.781961 -0.437534
H -7.675512 -2.394957 1.572119
H -8.124439 0.339210 -1.751859
H -9.015663 -1.512165 -0.337494


%chk=000180834-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180834

0 1
S 5.149437 0.727428 -0.987760
F 5.971266 -1.906340 -0.286863
F 4.970359 -0.746352 1.408274
F 7.729445 -1.047874 1.912952
F 8.197599 -0.204197 -0.177139
F 0.517595 -1.249190 -2.416031
F -6.531038 0.969050 2.383971
F -4.683902 -1.356365 -1.470246
O 5.561977 0.252702 -2.485531
O 5.617421 2.141067 -0.312297
O -1.506832 1.626472 1.135471
O -4.381714 1.958886 0.993770
N -0.882314 0.131290 -0.575983
N -3.102957 0.181577 0.133933
C 3.292380 0.549088 -0.801875
C 5.911248 -0.676380 0.361878
C 2.638772 -0.319161 -1.695995
C 2.625596 1.314722 0.167631
C 7.263899 -0.170790 0.889764
C 0.509714 0.331924 -0.590711
C 1.254977 -0.400876 -1.557273
C 1.223277 1.209594 0.271711
C -1.804898 0.740111 0.304692
C -5.534385 -0.104479 0.443439
C -4.311669 0.788165 0.560086
C -6.634463 0.064007 1.330388
C -5.739349 -1.092738 -0.551204
C -7.833463 -0.661795 1.225824
C -6.910764 -1.842037 -0.711458
C -7.970990 -1.613534 0.193781
H 3.174658 -0.877020 -2.469723
H 3.181947 2.001016 0.813034
H 7.196939 0.855047 1.288329
H 0.668744 1.798130 1.003802
H -1.237875 -0.487992 -1.310534
H -3.188336 -0.714802 -0.354427
H -8.631315 -0.476125 1.949245
H -6.981864 -2.574786 -1.518865
H -8.900320 -2.181644 0.096140


