WebMO Job Summary

Quantity	Value
Route	#N B3LYP/6-31G(d) OPT FREQ Geom=Connectivity
Stoichiometry	C8H12
Symmetry	C1
Basis	6-31G(d)
RB3LYP Energy	-312.019278204 Hartree
ZPE	0.176013 Hartree
Conditions	298.150K, 1.00000 atm
Internal Energy	-311.833697 Hartree
Enthalpy	-311.832753 Hartree
Free Energy	-311.877716 Hartree
Cv	34.009 cal/mol-K
Entropy	94.633 cal/mol-K
Dipole Moment	0.5203 Debye
Server	batch (570238)
CPU time	3445.2 sec

Step	Energy
0	-311.988038564
1	-312.007121052
2	-312.011500833
3	-312.015667281
4	-312.017444253
5	-312.018842607
6	-312.019184209
7	-312.019259741
8	-312.019271695
9	-312.019275955
10	-312.019277426
11	-312.019277922
12	-312.019278141
13	-312.019278204
14	-312.019278204
15	-312.019278204
Animation speed
Loop	None Loop Cycle

Constant	Frequency (GHz)	Frequency (cm-1)
a	2.66084	0.08875606871
b	1.41346	0.04714795060
c	1.08143	0.03607262195

Mode	Symmetry	Frequency (cm-1)	IR (Raman) Intensity	Actions
1	A	83.2176	0.2990
2	A	89.3497	0.4634
3	A	127.1154	0.2431
4	A	152.2633	1.0520
5	A	197.3904	0.2421
6	A	208.7857	0.5565
7	A	217.7666	0.4983
8	A	283.8388	0.2335
9	A	360.8778	2.4888
10	A	440.4901	4.1459
11	A	498.6926	2.8732
12	A	635.7173	3.6042
13	A	679.1198	41.1818
14	A	771.4052	8.0366
15	A	831.8795	6.8807
16	A	847.6755	3.6700
17	A	885.0370	4.0357
18	A	918.7391	8.4601
19	A	981.0768	6.1154
20	A	994.5560	1.9590
21	A	1003.4466	1.4905
22	A	1022.4675	21.2879
23	A	1069.9031	7.6680
24	A	1071.9940	0.9108
25	A	1079.3767	2.9725
26	A	1120.8171	0.4776
27	A	1140.9286	1.0142
28	A	1287.4094	0.0835
29	A	1291.7622	0.2353
30	A	1354.7760	0.5236
31	A	1368.3177	2.7860
32	A	1420.9994	6.4795
33	A	1441.4962	1.2275
34	A	1451.2665	2.6150
35	A	1482.9973	1.3921
36	A	1503.8729	8.1604
37	A	1507.1258	5.7112
38	A	1513.7252	9.3021
39	A	1520.8879	9.7076
40	A	1676.0110	2.6940
41	A	1711.9430	2.0489
42	A	1725.1001	8.7573
43	A	3022.3171	9.8731
44	A	3025.4166	47.9316
45	A	3067.8706	27.3688
46	A	3080.1917	28.3784
47	A	3112.5107	0.1770
48	A	3113.0725	20.5978
49	A	3121.5898	1.6881
50	A	3126.3774	44.0010
51	A	3134.9893	7.1823
52	A	3148.1474	62.4729
53	A	3157.4205	38.0060
54	A	3179.0805	13.4436
Frequency Scale Factor
Normal Mode Amplitude
Animation Speed
IR Spectrum
Peak Width (cm-1)

I WOULD TAKE COUNSEL OF MYSELF. I WOULD STOP AND LOOK WITHIN AND LOOKING WITHIN, LOOK BACK, ALSO THAT I MAY LOOK AHEAD WITH CLEARER UNDERSTANDING OF THE WAY I HAVE BEEN MOVING, AND IN WHAT DIRECTION. I NEED TO KNOW IF I AM GOING FORWARD OR RETREATING, WHETHER I HAVE BEEN WASTING, OR ENJOYING THE PRECIOUS MOMENTS OF LIFE. THERE HAVE BEEN FRICTIONS, ANNOYANCES AND SOMETIMES WRATH, BUT WERE THEY BECAUSE I WAS RIGHT AND OTHERS WRONG..... HAVE I HAD MY THOUGHTS TOO SHARPLY FOCUSED ON THAT WHICH PLEASED ME, SERVED MY SELF-ESTEEM, UNDERGIRDED MY SECURITY, OF WHICH I DID NOT INQUIRE WHETHER IT SERVED OR HAMPERED OTHERS..... HAVE I BEEN TRYING TO STOP THE CLOCK TO HOLD THE WORLD IN PERPETUATION OF WHAT WAS AN IS ALREADY SLIPPING AWAY..... HAVE I BEEN CRITICAL OF OTHERS FOR WHAT REALLY NEEDED CHANGING IN ME... LET ME INDEED TAKE COUNSEL OF MYSELF AND SET MY DIRECTIONS STRAIGHT. R.T. WESTON AS ADAPTED BY D. OSBORN 1967