WebMO Job Summary

Quantity	Value
Route	#N B3LYP/6-311+G(2d,p) SP GFINPUT POP=(FULL,NBORead)
Method	B3LYP
Stoichiometry	CCl2
Symmetry	C2V
Basis	6-311+G(2d,p)
RB3LYP Energy	-958.460610899 Hartree
Dipole Moment	1.1226 Debye
Server	class (274078)
CPU time	75.8 sec

Constant	Frequency (GHz)	Frequency (cm-1)
a	49.3573348	1.64638347240
b	3.5907308	0.11977388704
c	3.3472215	0.11165129111

Atom	Symbol	Charge
1	C	-0.361710
2	Cl	0.180855
3	Cl	0.180855

					Show all
Orbital	Symmetry	Occupancy	Spin	Energy ()	Actions
1	B2	2	-	-101.60201
2	A1	2	-	-101.60201
3	A1	2	-	-10.33366
4	B2	2	-	-9.51592
5	A1	2	-	-9.5159
6	B2	2	-	-7.27908
7	A1	2	-	-7.27908
8	A2	2	-	-7.27323
9	B1	2	-	-7.27323
10	A1	2	-	-7.26952
11	B2	2	-	-7.26952
12	A1	2	-	-0.94098
13	B2	2	-	-0.86568
14	A1	2	-	-0.6177
15	B2	2	-	-0.47862
16	B1	2	-	-0.42238
17	A1	2	-	-0.42217
18	A2	2	-	-0.36191
19	B2	2	-	-0.3398
20	A1	2	-	-0.27572
21	B1	0	-	-0.13732
22	A1	0	-	-0.0272
23	B2	0	-	0.01009
24	A1	0	-	0.01438
25	B1	0	-	0.05438
26	A1	0	-	0.05816
27	B2	0	-	0.06028
28	A1	0	-	0.08655
29	A2	0	-	0.08779
30	B2	0	-	0.09305
31	A1	0	-	0.10402
32	B1	0	-	0.10597
33	B2	0	-	0.12223
34	A1	0	-	0.15017
35	B2	0	-	0.17997
36	A1	0	-	0.33971
37	A2	0	-	0.35467
38	B1	0	-	0.36716
39	B2	0	-	0.36878
40	A1	0	-	0.40399
41	B2	0	-	0.40827
42	B1	0	-	0.41412
43	A1	0	-	0.4238
44	A2	0	-	0.42773
45	B2	0	-	0.43763
46	A1	0	-	0.44278
47	B1	0	-	0.46746
48	A2	0	-	0.48714
49	B2	0	-	0.50567
50	A1	0	-	0.55708
51	B1	0	-	0.57575
52	A1	0	-	0.63082
53	B2	0	-	0.65674
54	B2	0	-	0.7283
55	A1	0	-	0.74884
56	B1	0	-	0.91202
57	A1	0	-	0.93983
58	A2	0	-	0.95571
59	B2	0	-	1.09288
60	A1	0	-	1.10986
61	A1	0	-	1.23904
62	B2	0	-	1.26242
63	B1	0	-	2.19137
64	A2	0	-	2.21072
65	B2	0	-	2.21435
66	A1	0	-	2.25698
67	A1	0	-	2.29058
68	B2	0	-	2.29988
69	B1	0	-	2.30007
70	B2	0	-	2.33444
71	A2	0	-	2.33694
72	A1	0	-	2.36792
73	A2	0	-	2.41867
74	B1	0	-	2.44935
75	A1	0	-	2.46684
76	B2	0	-	2.52467
77	B2	0	-	2.60545
78	B1	0	-	2.6529
79	A1	0	-	2.66361
80	A1	0	-	2.99365
81	B2	0	-	3.16903
82	B1	0	-	3.24386
83	A2	0	-	3.25834
84	A1	0	-	3.28661
85	A1	0	-	3.41585
86	B2	0	-	3.48088
87	A1	0	-	9.63572
88	B2	0	-	9.70767
89	A1	0	-	23.24223
90	B1	0	-	25.76183
91	A2	0	-	25.78484
92	B2	0	-	25.7979
93	A1	0	-	25.91212
94	B2	0	-	26.61239
95	A1	0	-	27.07892
96	A1	0	-	215.62677
97	B2	0	-	215.69791
Electron density
Electrostatic potential
Electrophilic (HOMO) frontier density
Nucleophilic (LUMO) frontier density
Radical frontier density

Atom	Symbol	Charge
1	C	-0.12727
2	Cl	0.06364
3	Cl	0.06364

					Show all
Orbital	Description	Occupancy	Spin	Energy ()	Actions
1	C1 Cor(1S)	1.999794515	-	-10.276149892
2	C1 Val(2S)	1.684108940	-	-0.531620555
3	C1 Ryd(3S)	0.012035330	-	0.661880030
4	C1 Ryd(4S)	0.000124597	-	0.663340551
5	C1 Ryd(5S)	0.000000568	-	22.851931556
6	C1 Val(2p)	0.477193903	-	-0.187383199
7	C1 Ryd(3p)	0.000762723	-	0.403317985
8	C1 Ryd(4p)	0.000001143	-	1.326927791
9	C1 Ryd(5p)	0.000032024	-	1.558435038
10	C1 Val(2p)	0.733159226	-	-0.186793736
11	C1 Ryd(3p)	0.012318323	-	0.450695099
12	C1 Ryd(5p)	0.000131115	-	1.632489427
13	C1 Ryd(4p)	0.000154000	-	1.601712393
14	C1 Val(2p)	1.167657707	-	-0.214510041
15	C1 Ryd(3p)	0.004817714	-	0.440960974
16	C1 Ryd(4p)	0.000281170	-	1.532895688
17	C1 Ryd(5p)	0.000094471	-	1.534179508
18	C1 Ryd(3d)	0.002677809	-	0.674106058
19	C1 Ryd(4d)	0.000007383	-	3.190958425
20	C1 Ryd(3d)	0.006129013	-	0.673382039
21	C1 Ryd(4d)	0.000017061	-	3.177651531
22	C1 Ryd(3d)	0.007817107	-	1.105048695
23	C1 Ryd(4d)	0.000147097	-	3.401932813
24	C1 Ryd(3d)	0.004136387	-	0.844651635
25	C1 Ryd(4d)	0.000116457	-	3.252763822
26	C1 Ryd(3d)	0.013403951	-	0.679248604
27	C1 Ryd(4d)	0.000151992	-	3.241900578
28	Cl2 Cor(1S)	1.999999948	-	-100.265525417
29	Cl2 Cor(2S)	1.999614582	-	-10.527176799
30	Cl2 Val(3S)	1.856733251	-	-1.067042821
31	Cl2 Ryd(4S)	0.007577215	-	0.329277402
32	Cl2 Ryd(5S)	0.000628175	-	1.233192403
33	Cl2 Ryd(6S)	0.000004056	-	17.744214116
34	Cl2 Ryd(7S)	0.000000002	-	207.003326546
35	Cl2 Cor(2p)	1.999980063	-	-7.269677602
36	Cl2 Val(3p)	1.753822880	-	-0.358955484
37	Cl2 Ryd(4p)	0.000440640	-	0.347372801
38	Cl2 Ryd(5p)	0.000168176	-	0.555458349
39	Cl2 Ryd(6p)	0.000002054	-	5.171811871
40	Cl2 Ryd(7p)	0.000000390	-	22.426806717
41	Cl2 Cor(2p)	1.999933441	-	-7.271634697
42	Cl2 Val(3p)	1.527646572	-	-0.343921489
43	Cl2 Ryd(4p)	0.004473511	-	0.380959734
44	Cl2 Ryd(5p)	0.000319632	-	0.630234952
45	Cl2 Ryd(6p)	0.000015958	-	6.131632823
46	Cl2 Ryd(7p)	0.000004571	-	22.087688597
47	Cl2 Cor(2p)	1.999954997	-	-7.268292284
48	Cl2 Val(3p)	1.770394182	-	-0.348908003
49	Cl2 Ryd(4p)	0.004162630	-	0.362879596
50	Cl2 Ryd(5p)	0.000176856	-	0.613686577
51	Cl2 Ryd(6p)	0.000012388	-	5.559271753
52	Cl2 Ryd(7p)	0.000001619	-	22.285667215
53	Cl2 Ryd(3d)	0.001628921	-	0.733767045
54	Cl2 Ryd(4d)	0.000022339	-	2.274136044
55	Cl2 Ryd(3d)	0.000519379	-	0.689382254
56	Cl2 Ryd(4d)	0.000004628	-	2.196568380
57	Cl2 Ryd(3d)	0.004111390	-	1.062850962
58	Cl2 Ryd(4d)	0.000027555	-	2.544764492
59	Cl2 Ryd(3d)	0.002243996	-	0.899779668
60	Cl2 Ryd(4d)	0.000032694	-	2.410002053
61	Cl2 Ryd(3d)	0.001684463	-	0.770283847
62	Cl2 Ryd(4d)	0.000020983	-	2.311085526
63	Cl3 Cor(1S)	1.999999948	-	-100.265525417
64	Cl3 Cor(2S)	1.999614582	-	-10.527176799
65	Cl3 Val(3S)	1.856733251	-	-1.067042821
66	Cl3 Ryd(4S)	0.007577215	-	0.329277402
67	Cl3 Ryd(5S)	0.000628175	-	1.233192403
68	Cl3 Ryd(6S)	0.000004056	-	17.744214085
69	Cl3 Ryd(7S)	0.000000002	-	207.003326577
70	Cl3 Cor(2p)	1.999980063	-	-7.269677602
71	Cl3 Val(3p)	1.753822880	-	-0.358955484
72	Cl3 Ryd(4p)	0.000440640	-	0.347372801
73	Cl3 Ryd(5p)	0.000168176	-	0.555458349
74	Cl3 Ryd(6p)	0.000002054	-	5.171811871
75	Cl3 Ryd(7p)	0.000000390	-	22.426806717
76	Cl3 Cor(2p)	1.999933441	-	-7.271634697
77	Cl3 Val(3p)	1.527646572	-	-0.343921489
78	Cl3 Ryd(4p)	0.004473511	-	0.380959734
79	Cl3 Ryd(5p)	0.000319632	-	0.630234952
80	Cl3 Ryd(6p)	0.000015958	-	6.131632823
81	Cl3 Ryd(7p)	0.000004571	-	22.087688597
82	Cl3 Cor(2p)	1.999954997	-	-7.268292284
83	Cl3 Val(3p)	1.770394182	-	-0.348908003
84	Cl3 Ryd(4p)	0.004162630	-	0.362879596
85	Cl3 Ryd(5p)	0.000176856	-	0.613686578
86	Cl3 Ryd(6p)	0.000012388	-	5.559271753
87	Cl3 Ryd(7p)	0.000001619	-	22.285667215
88	Cl3 Ryd(3d)	0.001628921	-	0.733767045
89	Cl3 Ryd(4d)	0.000022339	-	2.274136044
90	Cl3 Ryd(3d)	0.000519379	-	0.689382254
91	Cl3 Ryd(4d)	0.000004628	-	2.196568380
92	Cl3 Ryd(3d)	0.004111390	-	1.062850962
93	Cl3 Ryd(4d)	0.000027555	-	2.544764492
94	Cl3 Ryd(3d)	0.002243996	-	0.899779668
95	Cl3 Ryd(4d)	0.000032694	-	2.410002053
96	Cl3 Ryd(3d)	0.001684463	-	0.770283847
97	Cl3 Ryd(4d)	0.000020983	-	2.311085526

					Show all
Orbital	Description	Occupancy	Spin	Energy ()	Actions
1	BD(1)C1(Cl2) 1s(14.10%)p6.02(84.95%)d0.07(0.95%)	0.816505704	-	-0.234604900
2	BD(1)Cl2(C1) 2s(17.94%)p4.56(81.72%)d0.02(0.34%)	1.217318708	-	-0.399947354
3	BD(1)C1(Cl3) 1s(0.00%)p1.00(98.32%)d0.02(1.68%)	0.482107960	-	-0.187355341
4	BD(1)Cl3(C1) 3s(0.00%)p1.00(99.89%)d0.00(0.11%)	1.755629057	-	-0.358346738
5	BD(2)C1(Cl3) 1s(14.10%)p6.02(84.95%)d0.07(0.95%)	0.816505704	-	-0.234604900
6	BD(2)Cl3(C1) 3s(17.94%)p4.56(81.72%)d0.02(0.34%)	1.217318708	-	-0.399947354
7	CR(1)C1 s(100.00%)	1.999794533	-	-10.275873631
8	CR(1)Cl2 s(100.00%)	1.999999948	-	-100.265530941
9	CR(2)Cl2 s(100.00%)p0.00(0.00%)	1.999613057	-	-10.528122621
10	CR(3)Cl2 s(0.00%)p1.00(100.00%)	1.999980063	-	-7.269677602
11	CR(4)Cl2 s(0.00%)p1.00(100.00%)	1.999933315	-	-7.271594410
12	CR(5)Cl2 s(0.00%)p1.00(100.00%)	1.999954787	-	-7.268314893
13	CR(1)Cl3 s(100.00%)	1.999999948	-	-100.265530941
14	CR(2)Cl3 s(100.00%)p0.00(0.00%)	1.999613057	-	-10.528122621
15	CR(3)Cl3 s(0.00%)p1.00(100.00%)	1.999980043	-	-7.269675846
16	CR(4)Cl3 s(0.00%)p1.00(100.00%)	1.999933315	-	-7.271594410
17	CR(5)Cl3 s(0.00%)p1.00(100.00%)	1.999954787	-	-7.268314893
18	LP(1)C1 s(72.47%)p0.38(27.18%)d0.00(0.35%)	1.989929932	-	-0.448202355
19	LP(1)Cl2 s(77.97%)p0.28(22.02%)d0.00(0.01%)	1.995548914	-	-0.951243306
20	LP(2)Cl2 s(4.50%)p21.21(95.49%)d0.00(0.01%)	1.956889790	-	-0.392130329
21	LP(3)Cl2 s(0.00%)p1.00(99.91%)d0.00(0.09%)	1.755647457	-	-0.358540590
22	LP(1)Cl3 s(77.97%)p0.28(22.02%)d0.00(0.01%)	1.995548914	-	-0.951243306
23	LP(2)Cl3 s(4.50%)p21.21(95.49%)d0.00(0.01%)	1.956889790	-	-0.392130329
24	RY*(1)C1 s(0.00%)p1.00(91.61%)d0.09(8.39%)	0.008597928	-	0.391420447
25	RY*(2)C1 s(51.70%)p0.13(6.73%)d0.80(41.57%)	0.005615659	-	0.560329764
26	RY*(3)C1 s(0.00%)p1.00(0.41%)d99.99(99.59%)	0.004701985	-	0.711390651
27	RY*(4)C1 s(4.31%)p14.28(61.51%)d7.94(34.18%)	0.002442676	-	0.602723863
28	RY*(5)C1 s(0.00%)p1.00(27.79%)d2.60(72.21%)	0.000913809	-	1.155915636
29	RY*(6)C1 s(79.64%)p0.13(10.68%)d0.12(9.67%)	0.000069561	-	0.451663196
30	RY*(7)C1 s(0.00%)p1.00(80.42%)d0.24(19.58%)	0.000048388	-	0.505871474
31	RY*(8)C1 s(9.61%)p6.53(62.72%)d2.88(27.67%)	0.000026606	-	1.981134709
32	RY*(9)C1 s(0.00%)p1.00(100.00%)d0.00(0.00%)	0.000008564	-	0.404627411
33	RY*(10)C1 s(0.00%)p1.00(100.00%)	0.000000817	-	1.326916853
34	RY*(11)C1 s(31.40%)p1.27(40.00%)d0.91(28.60%)	0.000000093	-	1.354091506
35	RY*(12)C1 s(3.66%)p25.39(92.96%)d0.92(3.38%)	0.000000006	-	0.758121814
36	RY*(13)C1 s(0.00%)p1.00(100.00%)d0.00(0.00%)	0.000000167	-	1.558306237
37	RY*(14)C1 s(0.00%)p0.00(0.00%)d1.00(100.00%)	0.000000000	-	3.149877515
38	RY*(15)C1 s(0.00%)p1.00(1.27%)d77.89(98.73%)	0.000001561	-	0.675804996
39	RY*(16)C1 s(0.00%)p0.00(0.00%)d1.00(100.00%)	0.000000005	-	3.177827347
40	RY*(17)C1 s(99.96%)p0.00(0.02%)d0.00(0.02%)	0.000000002	-	22.953702734
41	RY*(18)C1 s(0.00%)p1.00(1.31%)d75.23(98.69%)	0.000000010	-	3.163202367
42	RY*(19)C1 s(0.00%)p1.00(99.92%)d0.00(0.08%)	0.000000002	-	2.964247282
43	RY*(20)C1 s(7.12%)p0.55(3.92%)d12.50(88.96%)	0.000000014	-	3.065813494
44	RY*(21)C1 s(11.21%)p2.07(23.25%)d5.85(65.54%)	0.000000039	-	0.759529477
45	RY*(22)C1 s(0.72%)p0.12(0.09%)d99.99(99.19%)	0.000000000	-	3.212075174
46	RY*(1)Cl2 s(22.17%)p1.64(36.46%)d1.87(41.37%)	0.007038873	-	0.539620130
47	RY*(2)Cl2 s(12.80%)p4.65(59.51%)d2.16(27.70%)	0.002714406	-	0.622328763
48	RY*(3)Cl2 s(0.00%)p1.00(37.51%)d1.67(62.49%)	0.000961167	-	0.596674651
49	RY*(4)Cl2 s(52.40%)p0.29(15.21%)d0.62(32.39%)	0.000686432	-	0.452558612
50	RY*(5)Cl2 s(17.10%)p3.93(67.20%)d0.92(15.70%)	0.000058480	-	1.202634245
51	RY*(6)Cl2 s(0.00%)p1.00(89.63%)d0.12(10.37%)	0.000000019	-	0.520246530
52	RY*(7)Cl2 s(0.00%)p1.00(99.94%)d0.00(0.06%)	0.000000001	-	5.194392931
53	RY*(8)Cl2 s(0.00%)p1.00(100.00%)d0.00(0.00%)	0.000000000	-	22.418441062
54	RY*(9)Cl2 s(99.07%)p0.01(0.81%)d0.00(0.13%)	0.000000159	-	17.215548600
55	RY*(10)Cl2 s(35.82%)p1.46(52.36%)d0.33(11.83%)	0.000000133	-	1.085664349
56	RY*(11)Cl2 s(0.73%)p99.99(99.19%)d0.11(0.08%)	0.000002154	-	5.787267782
57	RY*(12)Cl2 s(0.09%)p99.99(99.83%)d0.96(0.08%)	0.000000320	-	22.255825022
58	RY*(13)Cl2 s(7.05%)p8.78(61.90%)d4.40(31.05%)	0.000002268	-	0.553786040
59	RY*(14)Cl2 s(100.00%)p0.00(0.00%)d0.00(0.00%)	0.000000000	-	207.053578683
60	RY*(15)Cl2 s(0.74%)p99.99(99.00%)d0.34(0.25%)	0.000000697	-	5.521525639
61	RY*(16)Cl2 s(0.13%)p99.99(99.78%)d0.71(0.09%)	0.000000141	-	22.282107878
62	RY*(17)Cl2 s(18.43%)p3.40(62.71%)d1.02(18.86%)	0.000000577	-	1.055575076
63	RY*(18)Cl2 s(0.00%)p1.00(0.16%)d99.99(99.84%)	0.000000185	-	2.308153994
64	RY*(19)Cl2 s(0.00%)p1.00(3.41%)d28.33(96.59%)	0.000000054	-	0.657602408
65	RY*(20)Cl2 s(0.00%)p0.00(0.00%)d1.00(100.00%)	0.000000060	-	2.196842295
66	RY*(21)Cl2 s(0.00%)p1.00(69.45%)d0.44(30.55%)	0.000000463	-	0.502534696
67	RY*(22)Cl2 s(0.02%)p4.07(0.07%)d99.99(99.91%)	0.000003437	-	2.545914466
68	RY*(23)Cl2 s(21.71%)p1.94(42.21%)d1.66(36.08%)	0.000003946	-	0.659139139
69	RY*(24)Cl2 s(0.28%)p8.19(2.33%)d99.99(97.38%)	0.000000155	-	2.480587039
70	RY*(25)Cl2 s(10.13%)p0.10(1.04%)d8.77(88.83%)	0.000003013	-	0.746996836
71	RY*(26)Cl2 s(0.94%)p1.22(1.15%)d99.99(97.92%)	0.000000957	-	2.284522307
72	RY*(1)Cl3 s(22.17%)p1.64(36.46%)d1.87(41.37%)	0.007038873	-	0.539620130
73	RY*(2)Cl3 s(12.80%)p4.65(59.51%)d2.16(27.70%)	0.002714406	-	0.622328763
74	RY*(3)Cl3 s(0.00%)p1.00(37.52%)d1.67(62.48%)	0.000979589	-	0.596479049
75	RY*(4)Cl3 s(52.40%)p0.29(15.21%)d0.62(32.39%)	0.000686432	-	0.452558612
76	RY*(5)Cl3 s(17.10%)p3.93(67.20%)d0.92(15.70%)	0.000058480	-	1.202634242
77	RY*(6)Cl3 s(0.00%)p1.00(89.63%)d0.12(10.37%)	0.000000019	-	0.520235075
78	RY*(7)Cl3 s(0.00%)p1.00(99.94%)d0.00(0.06%)	0.000000001	-	5.194225606
79	RY*(8)Cl3 s(0.00%)p1.00(100.00%)d0.00(0.00%)	0.000000000	-	22.418428627
80	RY*(9)Cl3 s(1.09%)p46.75(51.06%)d43.80(47.84%)	0.000001097	-	0.697633130
81	RY*(10)Cl3 s(64.38%)p0.46(29.47%)d0.10(6.15%)	0.000001787	-	0.960407831
82	RY*(11)Cl3 s(0.69%)p99.99(99.17%)d0.21(0.14%)	0.000002138	-	5.833516014
83	RY*(12)Cl3 s(0.09%)p99.99(99.80%)d1.21(0.11%)	0.000000324	-	22.237463408
84	RY*(13)Cl3 s(98.94%)p0.01(0.97%)d0.00(0.09%)	0.000000192	-	17.197292867
85	RY*(14)Cl3 s(5.62%)p14.51(81.53%)d2.29(12.86%)	0.000000614	-	0.654904828
86	RY*(15)Cl3 s(0.78%)p99.99(98.64%)d0.75(0.59%)	0.000000686	-	5.544735834
87	RY*(16)Cl3 s(0.13%)p99.99(99.78%)d0.72(0.09%)	0.000000142	-	22.278139191
88	RY*(17)Cl3 s(100.00%)p0.00(0.00%)d0.00(0.00%)	0.000000000	-	207.053889883
89	RY*(18)Cl3 s(0.00%)p1.00(0.14%)d99.99(99.86%)	0.000000181	-	2.302393737
90	RY*(19)Cl3 s(0.00%)p1.00(3.45%)d28.03(96.55%)	0.000000058	-	0.663535305
91	RY*(20)Cl3 s(0.00%)p0.00(0.00%)d1.00(100.00%)	0.000000060	-	2.196829319
92	RY*(21)Cl3 s(0.00%)p1.00(69.44%)d0.44(30.56%)	0.000000463	-	0.502566241
93	RY*(22)Cl3 s(0.02%)p3.85(0.07%)d99.99(99.91%)	0.000003442	-	2.544356752
94	RY*(23)Cl3 s(18.17%)p2.06(37.45%)d2.44(44.38%)	0.000000994	-	1.024221696
95	RY*(24)Cl3 s(0.12%)p35.93(4.41%)d99.99(95.47%)	0.000000209	-	2.380860649
96	RY*(25)Cl3 s(4.59%)p3.81(17.51%)d16.97(77.90%)	0.000005180	-	0.802179450
97	RY*(26)Cl3 s(0.50%)p5.08(2.54%)d99.99(96.95%)	0.000001151	-	2.318437328

					Show all
Orbital	Description	NHOs	Occupancy	Spin	Energy ()	Actions
1	BD(1)C1-Cl2	1, 2	1.993449209	-	-0.741866123
2	BD(1)C1-Cl3	3, 4	1.999039397	-	-0.399316409
3	BD(2)C1-Cl3	5, 6	1.993449209	-	-0.741866123
4	CR(1)C1	7	1.999794533	-	-10.275873631
5	CR(1)Cl2	8	1.999999948	-	-100.265530941
6	CR(2)Cl2	9	1.999613056	-	-10.528122616
7	CR(3)Cl2	10	1.999980063	-	-7.269677602
8	CR(4)Cl2	11	1.999933315	-	-7.271594410
9	CR(5)Cl2	12	1.999954787	-	-7.268314893
10	CR(1)Cl3	13	1.999999948	-	-100.265530941
11	CR(2)Cl3	14	1.999613056	-	-10.528122616
12	CR(3)Cl3	15	1.999980043	-	-7.269675846
13	CR(4)Cl3	16	1.999933315	-	-7.271594410
14	CR(5)Cl3	17	1.999954787	-	-7.268314893
15	LP(1)C1	18	1.989929932	-	-0.448202355
16	LP(1)Cl2	19	1.995548913	-	-0.951243305
17	LP(2)Cl2	20	1.956889790	-	-0.392130329
18	LP(3)Cl2	21	1.755647457	-	-0.358540590
19	LP(1)Cl3	22	1.995548913	-	-0.951243305
20	LP(2)Cl3	23	1.956889790	-	-0.392130329
21	RY*(1)C1	24	0.008597928	-	0.391420447
22	RY*(2)C1	25	0.005615659	-	0.560329764
23	RY*(3)C1	26	0.004701985	-	0.711390651
24	RY*(4)C1	27	0.002442676	-	0.602723863
25	RY*(5)C1	28	0.000913809	-	1.155915636
26	RY*(6)C1	29	0.000069561	-	0.451663196
27	RY*(7)C1	30	0.000048388	-	0.505871474
28	RY*(8)C1	31	0.000026606	-	1.981134709
29	RY*(9)C1	32	0.000008564	-	0.404627411
30	RY*(10)C1	33	0.000000817	-	1.326916853
31	RY*(11)C1	34	0.000000093	-	1.354091506
32	RY*(12)C1	35	0.000000006	-	0.758121814
33	RY*(13)C1	36	0.000000167	-	1.558306237
34	RY*(14)C1	37	0.000000000	-	3.149877515
35	RY*(15)C1	38	0.000001561	-	0.675804996
36	RY*(16)C1	39	0.000000005	-	3.177827347
37	RY*(17)C1	40	0.000000002	-	22.953702734
38	RY*(18)C1	41	0.000000010	-	3.163202367
39	RY*(19)C1	42	0.000000002	-	2.964247282
40	RY*(20)C1	43	0.000000014	-	3.065813494
41	RY*(21)C1	44	0.000000039	-	0.759529477
42	RY*(22)C1	45	0.000000000	-	3.212075174
43	RY*(1)Cl2	46	0.007038873	-	0.539620130
44	RY*(2)Cl2	47	0.002714406	-	0.622328763
45	RY*(3)Cl2	48	0.000961167	-	0.596674651
46	RY*(4)Cl2	49	0.000686432	-	0.452558612
47	RY*(5)Cl2	50	0.000058480	-	1.202634245
48	RY*(6)Cl2	51	0.000000019	-	0.520246530
49	RY*(7)Cl2	52	0.000000001	-	5.194392931
50	RY*(8)Cl2	53	0.000000000	-	22.418441062
51	RY*(9)Cl2	54	0.000000159	-	17.215548600
52	RY*(10)Cl2	55	0.000000133	-	1.085664349
53	RY*(11)Cl2	56	0.000002154	-	5.787267782
54	RY*(12)Cl2	57	0.000000320	-	22.255825022
55	RY*(13)Cl2	58	0.000002268	-	0.553786040
56	RY*(14)Cl2	59	0.000000000	-	207.053578683
57	RY*(15)Cl2	60	0.000000697	-	5.521525639
58	RY*(16)Cl2	61	0.000000141	-	22.282107878
59	RY*(17)Cl2	62	0.000000577	-	1.055575076
60	RY*(18)Cl2	63	0.000000185	-	2.308153994
61	RY*(19)Cl2	64	0.000000054	-	0.657602408
62	RY*(20)Cl2	65	0.000000060	-	2.196842295
63	RY*(21)Cl2	66	0.000000463	-	0.502534696
64	RY*(22)Cl2	67	0.000003437	-	2.545914466
65	RY*(23)Cl2	68	0.000003946	-	0.659139139
66	RY*(24)Cl2	69	0.000000155	-	2.480587039
67	RY*(25)Cl2	70	0.000003013	-	0.746996836
68	RY*(26)Cl2	71	0.000000957	-	2.284522307
69	RY*(1)Cl3	72	0.007038873	-	0.539620130
70	RY*(2)Cl3	73	0.002714406	-	0.622328763
71	RY*(3)Cl3	74	0.000979589	-	0.596479049
72	RY*(4)Cl3	75	0.000686432	-	0.452558612
73	RY*(5)Cl3	76	0.000058480	-	1.202634242
74	RY*(6)Cl3	77	0.000000019	-	0.520235075
75	RY*(7)Cl3	78	0.000000001	-	5.194225606
76	RY*(8)Cl3	79	0.000000000	-	22.418428627
77	RY*(9)Cl3	80	0.000001097	-	0.697633130
78	RY*(10)Cl3	81	0.000001787	-	0.960407831
79	RY*(11)Cl3	82	0.000002138	-	5.833516014
80	RY*(12)Cl3	83	0.000000324	-	22.237463408
81	RY*(13)Cl3	84	0.000000192	-	17.197292867
82	RY*(14)Cl3	85	0.000000614	-	0.654904828
83	RY*(15)Cl3	86	0.000000686	-	5.544735834
84	RY*(16)Cl3	87	0.000000142	-	22.278139191
85	RY*(17)Cl3	88	0.000000000	-	207.053889883
86	RY*(18)Cl3	89	0.000000181	-	2.302393737
87	RY*(19)Cl3	90	0.000000058	-	0.663535305
88	RY*(20)Cl3	91	0.000000060	-	2.196829319
89	RY*(21)Cl3	92	0.000000463	-	0.502566241
90	RY*(22)Cl3	93	0.000003442	-	2.544356752
91	RY*(23)Cl3	94	0.000000994	-	1.024221696
92	RY*(24)Cl3	95	0.000000209	-	2.380860649
93	RY*(25)Cl3	96	0.000005180	-	0.802179450
94	RY*(26)Cl3	97	0.000001151	-	2.318437328
95	BD*(1)C1-Cl2		0.040375202	-	0.107313869
96	BD*(1)C1-Cl3		0.238697620	-	-0.146385670
97	BD*(2)C1-Cl3		0.040375202	-	0.107313869

GOD GAVE US TWO ENDS... ONE TO SIT ON... AND THE OTHER TO THINK WITH... YOUR SUCCESS DEPENDS UPON WHICH END YOU USE THE MOST... IT'S A CASE OF HEADS YOU WIN TAILS YOU LOSE. SOURCE UNKNOWN(IT'S JUST AS WELL.)