%chk=000258946.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258946

0 1
S 1.099783 3.242165 0.030992
P 0.697456 1.380132 -0.009360
O -0.278250 0.904031 -1.338121
N -0.377097 0.786434 1.280245
C -1.536105 0.281445 0.604435
C -1.427051 0.310559 -0.819045
C 2.106664 0.219790 -0.074597
C -2.667785 -0.265940 1.193881
C -3.680921 -0.792961 0.361346
C -2.413857 -0.200854 -1.644720
C -3.548051 -0.758973 -1.032047
C 1.917751 -1.121225 0.267519
C 3.353092 0.700223 -0.479960
C -4.898558 -1.384029 0.994029
C 3.004998 -1.999681 0.201997
C 4.434810 -0.186669 -0.545039
C 4.259589 -1.531794 -0.204915
H -0.570296 1.398429 2.091596
H -2.772130 -0.296826 2.275586
H -2.309815 -0.161406 -2.727202
H -4.336140 -1.167056 -1.663461
H 0.944602 -1.503169 0.590987
H 3.513583 1.751432 -0.745957
H -5.454520 -0.628354 1.568509
H -5.597859 -1.806018 0.260219
H -4.636582 -2.194210 1.689841
H 2.874078 -3.047400 0.467052
H 5.412892 0.173596 -0.860327
H 5.104319 -2.219371 -0.256482


%chk=000258946-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258946

0 1
S 1.125803 3.334872 -0.176303
P 0.734501 1.310065 -0.125842
O -0.285012 0.570296 -1.435160
N -0.413847 0.713696 1.086228
C -1.598399 0.178266 0.523569
C -1.518034 0.119625 -0.897097
C 2.227840 0.217717 -0.123148
C -2.764405 -0.248930 1.184261
C -3.856834 -0.747421 0.420032
C -2.584238 -0.351416 -1.668733
C -3.752080 -0.792061 -0.992796
C 2.063134 -1.181465 0.015474
C 3.509871 0.791824 -0.273048
C -5.119019 -1.222349 1.121801
C 3.203823 -2.012345 0.006238
C 4.645416 -0.048379 -0.281288
C 4.493464 -1.447590 -0.142164
H -0.373125 1.032865 2.053500
H -2.834215 -0.201757 2.277344
H -2.506895 -0.375913 -2.759057
H -4.594360 -1.172354 -1.581149
H 1.063242 -1.613217 0.130304
H 3.604636 1.878857 -0.379753
H -5.551207 -0.428630 1.759882
H -5.891279 -1.524524 0.394045
H -4.916875 -2.091925 1.775971
H 3.087661 -3.096234 0.111297
H 5.643190 0.387741 -0.397337
H 5.375840 -2.097014 -0.150067


