WebMO Job Summary

Quantity	Value
Route	#N MP2/6-311+G(2d,p) OPT FREQ Geom=Connectivity
Stoichiometry	H2O4S
Symmetry	C1
Basis	6-311+G(2d,p)
RHF Energy	-698.200156943 Hartree
MP2 Energy	-699.23518453955 Hartree
ZPE	0.039126 Hartree
Conditions	298.150K, 1.00000 atm
Internal Energy	-699.190940 Hartree
Enthalpy	-699.189996 Hartree
Free Energy	-699.224293 Hartree
Cv	17.782 cal/mol-K
Entropy	72.186 cal/mol-K
Dipole Moment	3.4801 Debye
Server	batch (126891)
CPU time	6257.1 sec

Step	Energy
0	-697.966335942
1	-698.046688580
2	-698.181296028
3	-698.198082952
4	-698.198485299
5	-698.200011651
6	-698.201282701
7	-698.201218256
8	-698.200203631
9	-698.199804187
10	-698.200142728
11	-698.200156943
12	-698.200156943
13	-698.200156943
Animation speed
Loop	None Loop Cycle

Constant	Frequency (GHz)	Frequency (cm-1)
a	5.00728	0.16702488226
b	4.96628	0.16565726947
c	4.75895	0.15874148508

Atom	Symbol	Charge
1	S	1.608504
2	O	-0.503426
3	H	0.321627
4	O	-0.503426
5	H	0.321627
6	O	-0.622453
7	O	-0.622453

Mode	Symmetry	Frequency (cm-1)	IR (Raman) Intensity	Actions
1	A	263.6452	87.7866
2	A	339.4886	64.1400
3	A	371.2533	4.2821
4	A	438.2407	22.8377
5	A	485.6811	43.5481
6	A	533.2135	43.1820
7	A	541.0761	25.1106
8	A	801.1702	124.3514
9	A	851.5095	339.8530
10	A	1164.9051	81.4781
11	A	1176.4713	92.9317
12	A	1213.2972	157.8724
13	A	1465.9230	291.2739
14	A	3762.0767	218.0906
15	A	3766.4139	63.4630
Frequency Scale Factor
Normal Mode Amplitude
Animation Speed
IR Spectrum
Peak Width (cm-1)

THERE IS AN OLD, OLD RECIPE IN MAINE FOR STEWING COOT. PLACE THE BIRD IN A KETTLE OF WATER WITH A RED BUILDING BRICK FREE OF MORTAR AND BLEMISHES. PARBOIL THE COOT AND BRICK TOGETHER FOR THREE HOURS. POUR OFF THE WATER, REFILL THE KETTLE, AND AGAIN PARBOIL FOR THREE HOURS. ONCE AGAIN POUR OFF THE WATER, FOR THE LAST TIME ADD FRESH WATER, AND LET THE COOT AND BRICK SIMMER TOGETHER OVERNIGHT. IN THE MORNING, THROW AWAY THE COOT AND EAT THE BRICK.