%chk=000259149.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259149

0 1
S 0.222500 0.131995 0.046433
O -4.723992 0.457796 0.516126
N -2.457166 0.237108 0.267110
N -1.530859 -1.636752 -0.927117
C -2.230035 1.501410 1.024405
C -1.397298 -0.498099 -0.241980
C 1.312411 -1.151128 -0.657856
C 2.684349 -0.623964 -0.404744
C -3.835518 -0.222531 0.047919
C 3.361710 -0.958285 0.779274
C 3.306076 0.208152 -1.350057
C -3.930659 -1.454949 -0.703626
C -1.612227 2.570696 0.167367
C -2.818779 -2.109405 -1.154423
C 4.648737 -0.466483 1.010788
C 4.593180 0.696501 -1.111913
C 5.266474 0.360476 0.067043
C -0.850466 3.539708 0.669260
H -3.230078 1.862386 1.396848
H -1.620969 1.281872 1.932704
H 1.089462 -1.301211 -1.734762
H 1.121017 -2.132346 -0.177154
H 2.885195 -1.599903 1.519271
H 2.785942 0.475492 -2.269051
H -4.940954 -1.821065 -0.883265
H -1.861392 2.520860 -0.895266
H -2.867126 -3.046044 -1.724097
H 5.171491 -0.728439 1.929717
H 5.072586 1.341126 -1.847418
H 6.269480 0.741932 0.249776
H -0.429754 4.330126 0.062557
H -0.582535 3.624269 1.712731


%chk=000259149-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259149

0 1
S 0.291692 0.294729 0.257597
O -4.813920 0.467622 0.459394
N -2.465155 0.283746 0.320698
N -1.415748 -1.476265 -0.934733
C -2.370062 1.512579 1.169315
C -1.350598 -0.380565 -0.173495
C 1.406119 -1.066451 -0.526418
C 2.849656 -0.673434 -0.337163
C -3.819018 -0.175687 0.009949
C 3.569246 -1.097707 0.810317
C 3.513335 0.122204 -1.307404
C -3.854407 -1.372571 -0.810665
C -2.352306 2.781673 0.338958
C -2.677696 -1.961181 -1.243878
C 4.924783 -0.740074 0.982113
C 4.868577 0.481146 -1.137568
C 5.578063 0.050779 0.008138
C -1.359592 3.702861 0.379483
H -3.274688 1.499021 1.803580
H -1.474607 1.433881 1.809673
H 1.097577 -1.127931 -1.579712
H 1.137200 -2.005157 -0.020513
H 3.064746 -1.711018 1.566722
H 2.964869 0.457452 -2.195831
H -4.835824 -1.773895 -1.070984
H -3.235216 2.937294 -0.295574
H -2.688745 -2.859718 -1.869230
H 5.470311 -1.078179 1.870053
H 5.370726 1.091732 -1.896095
H 6.630105 0.327288 0.139590
H -1.409113 4.621381 -0.215513
H -0.469508 3.565745 1.005796


