%chk=000290761.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290761

0 1
S -2.989271 -0.279453 1.904617
O -3.402345 -1.697585 -0.158121
O 2.601260 1.670960 0.326335
O -1.514017 2.467527 2.123268
O -2.834282 2.326797 0.309941
O 1.268579 0.835698 -1.356178
N 0.463221 1.181954 0.806903
C -5.459090 -0.838845 0.885115
C -6.271514 -1.404736 -0.290438
C -4.038636 -0.553813 0.420807
C -5.557613 -2.620254 -0.896350
C -4.121433 -2.263655 -1.282753
C -1.306184 -0.498738 1.268677
C -0.923062 0.778629 0.518262
C -1.889514 1.904601 0.930929
C 1.419438 1.184032 -0.202153
C 3.768887 1.633107 -0.559450
C 4.410092 0.277016 -0.494825
C 5.503912 0.051728 0.352498
C 3.912740 -0.767990 -1.288135
C 6.103887 -1.210355 0.395813
C 4.514251 -2.027497 -1.239633
C 5.611465 -2.249335 -0.400201
H -5.934127 0.080409 1.279293
H -5.462463 -1.571979 1.719437
H -7.282500 -1.690783 0.055958
H -6.421715 -0.624316 -1.061520
H -3.965457 0.306135 -0.282695
H -5.548006 -3.450041 -0.161013
H -6.108435 -2.994587 -1.778645
H -3.506728 -3.152185 -1.512775
H -4.078379 -1.543988 -2.118264
H -1.241778 -1.392486 0.610945
H -0.649329 -0.700800 2.139206
H -1.042020 0.622671 -0.599595
H 0.683658 1.515050 1.747011
H 4.384071 2.439590 -0.116568
H 3.454117 1.909602 -1.584476
H -2.139808 3.182654 2.421986
H 5.885641 0.854854 0.980695
H 3.046146 -0.592996 -1.933778
H 6.954516 -1.383930 1.052552
H 4.126937 -2.837281 -1.856045
H 6.080387 -3.231187 -0.365338


%chk=000290761-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290761

0 1
S -3.237687 -0.378222 2.464303
O -2.880136 -1.595715 0.062682
O 2.290637 1.611725 0.033448
O -1.489923 2.978163 2.549553
O -2.997761 2.793543 0.787190
O 0.561221 0.563966 -1.194323
N 0.230638 1.443376 0.963033
C -5.255310 -1.290120 0.725239
C -5.699481 -1.604727 -0.728105
C -3.843027 -0.688094 0.700666
C -4.647529 -2.487883 -1.443179
C -3.254573 -1.838549 -1.351588
C -1.417002 -0.028943 2.099081
C -1.192081 1.102100 1.063927
C -2.011981 2.350857 1.408158
C 0.977481 1.146768 -0.158582
C 3.257086 1.285742 -1.071694
C 3.963097 -0.029866 -0.824780
C 5.222827 -0.058416 -0.174646
C 3.371819 -1.251118 -1.242141
C 5.882817 -1.285583 0.059378
C 4.029793 -2.478376 -1.006974
C 5.286677 -2.498687 -0.357023
H -5.958123 -0.583284 1.205237
H -5.236880 -2.218985 1.326237
H -6.685013 -2.105413 -0.719638
H -5.824637 -0.654970 -1.287600
H -3.844181 0.283877 0.162370
H -4.611205 -3.485949 -0.965937
H -4.917738 -2.633730 -2.507147
H -2.457584 -2.491804 -1.741438
H -3.236403 -0.874389 -1.906719
H -0.960646 -0.955090 1.720502
H -0.988019 0.243469 3.078042
H -1.515370 0.750133 0.071044
H 0.683513 1.927987 1.740138
H 3.954938 2.137466 -1.047870
H 2.690639 1.274539 -2.018787
H -2.035858 3.778678 2.774572
H 5.685307 0.882039 0.149962
H 2.393947 -1.227319 -1.736360
H 6.857080 -1.296995 0.560764
H 3.566222 -3.416592 -1.331755
H 5.797907 -3.451412 -0.177938


