%chk=000258923.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258923

0 1
S -1.607424 2.138420 -2.489662
P -1.039250 0.986196 -1.065543
O 4.722118 -1.111518 0.198137
N -0.075366 1.756758 0.217621
N 0.174704 -0.230168 -1.532410
C 1.127031 0.959397 0.331751
C 1.314308 -0.015879 -0.701921
C -2.391174 0.021556 -0.268388
C -0.790972 2.072463 1.479642
C 2.140459 1.181277 1.264755
C 2.503958 -0.733417 -0.810723
C -2.076483 -1.100227 0.501515
C -3.712179 0.427477 -0.453790
C 3.499202 -0.483545 0.150641
C 3.329574 0.453307 1.185209
C -3.109200 -1.822800 1.108640
C -4.741146 -0.299326 0.159771
C -4.439113 -1.420202 0.938385
C 5.029807 -2.084806 -0.829079
H 0.346330 -0.435712 -2.527759
H -0.113658 2.652462 2.134756
H -1.145952 1.199732 2.053075
H -1.649669 2.735818 1.264010
H 2.013186 1.929239 2.047276
H 2.639728 -1.461146 -1.601567
H -1.044354 -1.437106 0.635039
H -3.972454 1.295051 -1.071896
H 4.131769 0.608729 1.902771
H -2.879082 -2.700912 1.709320
H -5.776939 0.007639 0.023235
H -5.241839 -1.985606 1.412080
H 4.331388 -2.924786 -0.778443
H 6.042980 -2.397372 -0.542981
H 5.030712 -1.610293 -1.814568


%chk=000258923-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258923

0 1
S -1.733256 2.454704 -2.127480
P -1.115178 0.947503 -0.820688
O 4.891551 -1.107250 0.088250
N -0.133745 1.400107 0.595975
N 0.161290 -0.187318 -1.292895
C 1.161707 0.822919 0.572976
C 1.336223 -0.084457 -0.513906
C -2.547699 -0.082872 -0.213333
C -0.466237 2.546463 1.444119
C 2.230401 1.067198 1.459146
C 2.559311 -0.748828 -0.729403
C -2.293642 -1.168285 0.659737
C -3.862715 0.228909 -0.621952
C 3.622128 -0.500074 0.180788
C 3.459165 0.397207 1.262504
C -3.374321 -1.948508 1.125319
C -4.939407 -0.556364 -0.150850
C -4.696523 -1.643144 0.721115
C 5.122492 -2.015492 -1.032709
H 0.141393 -0.670534 -2.189336
H 0.287716 3.351219 1.340452
H -0.526909 2.245448 2.506942
H -1.442565 2.960215 1.139157
H 2.116741 1.763769 2.295457
H 2.672254 -1.433302 -1.575243
H -1.268002 -1.398198 0.968794
H -4.022276 1.074763 -1.301526
H 4.304575 0.560068 1.936603
H -3.187335 -2.790538 1.800516
H -5.962338 -0.320794 -0.463733
H -5.532680 -2.250795 1.084939
H 4.437866 -2.886726 -0.997998
H 6.160992 -2.359708 -0.917123
H 5.010025 -1.496609 -2.005713


