%chk=000280478.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280478

0 1
S -1.170987 -2.417111 0.198881
O -1.371680 -2.878265 -1.153330
O -1.512946 -3.292083 1.301063
O 4.052887 0.818944 -1.071423
O 2.142993 0.963884 -2.078714
N -1.863814 -0.042051 -0.540074
N -2.141385 -0.996614 0.473132
N 2.883484 0.508577 -1.221162
C 0.456771 -1.854210 0.407499
C -1.691599 1.307865 0.012975
C 1.012704 -0.965553 -0.511829
C 1.193437 -2.277129 1.519833
C 2.312793 -0.482725 -0.288858
C -2.874471 -0.048631 -1.647925
C 2.500837 -1.814475 1.717696
C -0.738325 2.106638 -0.644956
C -2.378475 1.793820 1.134445
C 3.066469 -0.910831 0.819127
C -0.487121 3.396463 -0.175351
C -2.109946 3.086609 1.594925
C -1.170815 3.889660 0.942150
H -3.132003 -1.119408 0.738695
H 0.452276 -0.629940 -1.400805
H 0.744544 -2.974798 2.242332
H -3.903132 0.178558 -1.335571
H -2.855291 -1.040824 -2.140648
H -2.574268 0.694623 -2.406122
H 3.073995 -2.156042 2.581169
H -0.192155 1.722572 -1.509613
H -3.103032 1.172894 1.656136
H 4.083897 -0.527201 0.963906
H 0.249520 4.020177 -0.682519
H -2.638942 3.467770 2.467756
H -0.968720 4.896335 1.302682


%chk=000280478-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000280478

0 1
S -1.017573 -2.002852 0.049252
O -1.052683 -1.153500 -1.393951
O -1.199560 -3.650634 0.007115
O 4.579604 1.024529 1.404500
O 2.629616 1.964996 0.689067
N -2.978765 0.266516 -0.206935
N -2.831103 -0.411589 0.934482
N 3.341719 0.948384 1.046750
C 0.783907 -1.774493 0.656738
C -2.213181 1.473638 -0.363102
C 1.362531 -0.500677 0.599764
C 1.462578 -2.910125 1.131139
C 2.692794 -0.388240 1.059521
C -3.866663 -0.188591 -1.313168
C 2.801477 -2.762595 1.567811
C -2.234525 2.180980 -1.592820
C -1.438147 1.954017 0.726838
C 3.425530 -1.498448 1.538504
C -1.478141 3.363139 -1.725710
C -0.678758 3.129037 0.572691
C -0.695643 3.841599 -0.650270
H -3.493077 -1.220568 0.930476
H 0.829529 0.371039 0.206579
H 0.947725 -3.877898 1.128376
H -4.368618 -1.115799 -0.995925
H -3.252206 -0.411765 -2.198800
H -4.623847 0.584139 -1.531603
H 3.354727 -3.633965 1.931888
H -2.804181 1.812275 -2.449145
H -1.442684 1.401081 1.669171
H 4.455411 -1.354789 1.875327
H -1.489240 3.902176 -2.678758
H -0.064466 3.486067 1.405043
H -0.096584 4.750414 -0.765342


