%chk=000245729.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245729

0 1
S 2.008705 -2.530364 -0.931159
O -0.369104 1.892405 0.705516
N 0.377963 -0.153639 -0.076447
C 1.783687 0.068580 -0.044310
C -2.008857 0.228361 0.157029
C -0.619799 0.773748 0.307480
C 2.652415 -0.984435 -0.403311
C 2.339185 1.308927 0.335530
C -2.899972 0.886425 -0.700644
C -2.421864 -0.890662 0.891319
C 4.036973 -0.800158 -0.402148
C 3.720817 1.477776 0.341561
C 4.576459 0.430361 -0.027649
C -4.207505 0.410460 -0.833478
C -3.732292 -1.357702 0.757222
C -4.622717 -0.710177 -0.106396
H 0.065973 -1.066552 -0.442572
H 1.683745 2.138926 0.625696
H -2.574754 1.769042 -1.253953
H -1.730908 -1.388810 1.571389
H 4.698070 -1.618327 -0.695399
H 4.141415 2.440690 0.636322
H 5.653653 0.578329 -0.023477
H -4.903971 0.916988 -1.500778
H -4.060405 -2.225526 1.327890
H -5.643462 -1.077849 -0.210168
H 2.149550 -3.231215 0.215733


%chk=000245729-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245729

0 1
S 1.960582 -2.736418 0.460053
O -0.422783 2.051126 -0.144344
N 0.421662 -0.132511 0.045886
C 1.818061 0.088469 0.023797
C -2.002455 0.207530 -0.100326
C -0.613534 0.796518 -0.075394
C 2.681143 -1.035614 0.216133
C 2.403208 1.368140 -0.191597
C -3.080158 1.089100 0.173084
C -2.280906 -1.151390 -0.409249
C 4.080466 -0.888406 0.160886
C 3.805751 1.502996 -0.229873
C 4.653375 0.384858 -0.059287
C -4.409337 0.620326 0.160282
C -3.613406 -1.618346 -0.426435
C -4.680283 -0.736713 -0.136128
H 0.169851 -1.121497 0.170974
H 1.742415 2.227023 -0.320854
H -2.845675 2.137312 0.384950
H -1.479049 -1.851043 -0.675751
H 4.713690 -1.771359 0.291574
H 4.237888 2.495527 -0.398644
H 5.741656 0.496670 -0.097013
H -5.232790 1.309051 0.378059
H -3.819061 -2.665059 -0.675510
H -5.713096 -1.102068 -0.149781
H 1.855784 -2.678618 1.845306


