WebMO Job Summary

Quantity	Value
Route	#N B3LYP/6-311+G(2d,p) SP GFINPUT POP=(FULL,NBO6Read) Geom=Connectivit
Stoichiometry	ClH2N
Symmetry	CS
Basis	6-311+G(2d,p)
RB3LYP Energy	-516.163797691 Hartree
Dipole Moment	2.0779 Debye
Server	batch (306096)
CPU time	3.1 sec

Constant	Frequency (GHz)	Frequency (cm-1)
a	269.3662645	8.98509142948
b	13.8329947	0.46141903610
c	13.5400678	0.45164804646

Atom	Symbol	Charge
1	N	-0.345055
2	Cl	-0.134586
3	H	0.239821
4	H	0.239821

Display Range		- / 74
Orbital	Symmetry	Occupancy	Energy	Actions
1	-	2	-101.57032 Hartree
2	-	2	-14.37449 Hartree
3	-	2	-9.48216 Hartree
4	-	2	-7.24913 Hartree
5	-	2	-7.23616 Hartree
6	-	2	-7.23571 Hartree
7	-	2	-0.94422 Hartree
8	-	2	-0.76834 Hartree
9	-	2	-0.52473 Hartree
10	-	2	-0.46353 Hartree
11	-	2	-0.37891 Hartree
12	-	2	-0.32045 Hartree
13	-	2	-0.27411 Hartree
14	-	0	-0.05441 Hartree
15	-	0	0.01118 Hartree
16	-	0	0.05819 Hartree
17	-	0	0.06351 Hartree
18	-	0	0.07643 Hartree
19	-	0	0.09342 Hartree
20	-	0	0.11209 Hartree
21	-	0	0.12603 Hartree
22	-	0	0.13531 Hartree
23	-	0	0.17338 Hartree
24	-	0	0.24618 Hartree
25	-	0	0.38751 Hartree
26	-	0	0.40635 Hartree
27	-	0	0.42885 Hartree
28	-	0	0.45181 Hartree
29	-	0	0.45869 Hartree
30	-	0	0.46375 Hartree
31	-	0	0.46982 Hartree
32	-	0	0.52713 Hartree
33	-	0	0.56921 Hartree
34	-	0	0.65902 Hartree
35	-	0	0.70373 Hartree
36	-	0	0.71140 Hartree
37	-	0	0.77094 Hartree
38	-	0	0.95717 Hartree
39	-	0	1.02596 Hartree
40	-	0	1.04783 Hartree
41	-	0	1.10978 Hartree
42	-	0	1.22199 Hartree
43	-	0	1.39686 Hartree
44	-	0	1.58779 Hartree
45	-	0	1.61588 Hartree
46	-	0	1.83792 Hartree
47	-	0	1.87568 Hartree
48	-	0	2.14166 Hartree
49	-	0	2.26361 Hartree
50	-	0	2.27503 Hartree
51	-	0	2.34286 Hartree
52	-	0	2.35067 Hartree
53	-	0	2.36260 Hartree
54	-	0	2.43145 Hartree
55	-	0	2.46103 Hartree
56	-	0	2.49117 Hartree
57	-	0	2.50555 Hartree
58	-	0	2.56353 Hartree
59	-	0	2.62584 Hartree
60	-	0	2.87590 Hartree
61	-	0	3.89117 Hartree
62	-	0	4.17013 Hartree
63	-	0	4.52668 Hartree
64	-	0	4.80154 Hartree
65	-	0	4.83125 Hartree
66	-	0	4.86859 Hartree
67	-	0	5.10056 Hartree
68	-	0	5.12482 Hartree
69	-	0	9.62134 Hartree
70	-	0	25.79345 Hartree
71	-	0	25.81858 Hartree
72	-	0	26.70088 Hartree
73	-	0	35.49636 Hartree
74	-	0	215.58699 Hartree
Electron density
Electrostatic potential
Electrophilic (HOMO) frontier density
Nucleophilic (LUMO) frontier density
Radical frontier density

Atom	Symbol	Charge
1	N	-0.78199
2	Cl	0.05908
3	H	0.36146
4	H	0.36146

Display Range		- / 74
Orbital	Description	Occupancy	Energy	Actions
1	N1 Cor(1s)	1.999991140	-14.374379566 Hartree
2	N1 Val(2s)	1.581863971	-0.587886259 Hartree
3	N1 Ryd(3s)	0.002055685	0.746054192 Hartree
4	N1 Ryd(4s)	0.000057833	1.436955890 Hartree
5	N1 Ryd(5s)	0.000005011	34.295430591 Hartree
6	N1 Val(2p)	1.733312900	-0.267905115 Hartree
7	N1 Ryd(3p)	0.005641779	0.444046351 Hartree
8	N1 Ryd(4p)	0.000207576	0.982866236 Hartree
9	N1 Ryd(5p)	0.000018217	3.692667681 Hartree
10	N1 Val(2p)	1.080945640	-0.252012592 Hartree
11	N1 Ryd(3p)	0.001960349	0.453457369 Hartree
12	N1 Ryd(4p)	0.000539138	0.962836474 Hartree
13	N1 Ryd(5p)	0.000010761	3.720951126 Hartree
14	N1 Val(2p)	1.350944981	-0.233594668 Hartree
15	N1 Ryd(3p)	0.001738646	0.455137975 Hartree
16	N1 Ryd(4p)	0.000252590	0.956979446 Hartree
17	N1 Ryd(5p)	0.000006152	4.228116434 Hartree
18	N1 Ryd(3d)	0.003666313	1.126290901 Hartree
19	N1 Ryd(4d)	0.000011865	4.783627133 Hartree
20	N1 Ryd(3d)	0.006356122	1.590894447 Hartree
21	N1 Ryd(4d)	0.000046946	4.960908564 Hartree
22	N1 Ryd(3d)	0.001295017	1.157905793 Hartree
23	N1 Ryd(4d)	0.000026362	4.815550016 Hartree
24	N1 Ryd(3d)	0.009060930	1.276486934 Hartree
25	N1 Ryd(4d)	0.000024723	4.957562960 Hartree
26	N1 Ryd(3d)	0.001943893	1.293934900 Hartree
27	N1 Ryd(4d)	0.000009829	4.843732765 Hartree
28	Cl2 Cor(1s)	1.999999995	-101.408558528 Hartree
29	Cl2 Cor(2s)	1.999991444	-9.643766489 Hartree
30	Cl2 Val(3s)	1.900307996	-0.758598082 Hartree
31	Cl2 Ryd(4s)	0.004498487	0.817214459 Hartree
32	Cl2 Ryd(5s)	0.000195750	3.236043002 Hartree
33	Cl2 Ryd(6s)	0.000000482	25.857158155 Hartree
34	Cl2 Ryd(7s)	0.000000006	198.805296880 Hartree
35	Cl2 Cor(2p)	1.999998720	-7.235704455 Hartree
36	Cl2 Val(3p)	1.994235415	-0.325289687 Hartree
37	Cl2 Ryd(4p)	0.002276425	0.389292197 Hartree
38	Cl2 Ryd(5p)	0.000079454	10.035483602 Hartree
39	Cl2 Ryd(6p)	0.000001661	0.367165867 Hartree
40	Cl2 Ryd(7p)	0.000000593	17.549827315 Hartree
41	Cl2 Cor(2p)	1.999998004	-7.249212736 Hartree
42	Cl2 Val(3p)	1.030664921	-0.267155634 Hartree
43	Cl2 Ryd(4p)	0.005055416	0.467889437 Hartree
44	Cl2 Ryd(5p)	0.000055172	10.420532257 Hartree
45	Cl2 Ryd(6p)	0.000039438	0.810030946 Hartree
46	Cl2 Ryd(7p)	0.000001707	15.527899765 Hartree
47	Cl2 Cor(2p)	1.999998747	-7.236155947 Hartree
48	Cl2 Val(3p)	1.987750198	-0.327923455 Hartree
49	Cl2 Ryd(4p)	0.001427548	0.386289767 Hartree
50	Cl2 Ryd(6p)	0.000002489	10.022978954 Hartree
51	Cl2 Ryd(5p)	0.000003216	0.381650791 Hartree
52	Cl2 Ryd(7p)	0.000000934	17.522697124 Hartree
53	Cl2 Ryd(3d)	0.004591577	0.679974948 Hartree
54	Cl2 Ryd(4d)	0.000008487	2.418697324 Hartree
55	Cl2 Ryd(3d)	0.000065717	0.528931501 Hartree
56	Cl2 Ryd(4d)	0.000004320	2.298990299 Hartree
57	Cl2 Ryd(3d)	0.001936598	0.696387585 Hartree
58	Cl2 Ryd(4d)	0.000002646	2.430196379 Hartree
59	Cl2 Ryd(3d)	0.005871782	0.886373586 Hartree
60	Cl2 Ryd(4d)	0.000016136	2.627754547 Hartree
61	Cl2 Ryd(3d)	0.001832693	0.647462045 Hartree
62	Cl2 Ryd(4d)	0.000007496	2.403773455 Hartree
63	H3 Val(1s)	0.636191951	0.060095248 Hartree
64	H3 Ryd(2s)	0.001212631	0.500261028 Hartree
65	H3 Ryd(3s)	0.000163296	2.215842016 Hartree
66	H3 Ryd(2p)	0.000518287	1.980644962 Hartree
67	H3 Ryd(2p)	0.000157893	1.815924734 Hartree
68	H3 Ryd(2p)	0.000297923	2.275802708 Hartree
69	H4 Val(1s)	0.636191951	0.060095248 Hartree
70	H4 Ryd(2s)	0.001212631	0.500261028 Hartree
71	H4 Ryd(3s)	0.000163296	2.215842016 Hartree
72	H4 Ryd(2p)	0.000518287	1.980644962 Hartree
73	H4 Ryd(2p)	0.000157893	1.815924734 Hartree
74	H4 Ryd(2p)	0.000297923	2.275802708 Hartree

Display Range		- / 74
Orbital	Description	Occupancy	Energy	Actions
1	CR(1)N1 s(100.00%)	1.999991140	-14.374379566 Hartree
2	CR(1)Cl2 s(100.00%)	1.999999995	-101.408558528 Hartree
3	CR(2)Cl2 s(100.00%)	1.999991444	-9.643766489 Hartree
4	CR(3)Cl2 s(0.00%)p1.00(100.00%)	1.999998720	-7.235704455 Hartree
5	CR(4)Cl2 s(0.00%)p1.00(100.00%)	1.999998004	-7.249212736 Hartree
6	CR(5)Cl2 s(0.00%)p1.00(100.00%)	1.999998747	-7.236155947 Hartree
7	LP(1)N1 s(35.97%)p1.77(63.75%)d0.01(0.29%)	1.992333175	-0.395237133 Hartree
8	LP(1)Cl2 s(86.44%)p0.16(13.55%)d0.00(0.00%)	1.999402077	-0.719541258 Hartree
9	LP(2)Cl2 s(4.23%)p22.66(95.77%)d0.00(0.01%)	1.994926683	-0.343532549 Hartree
10	LP(3)Cl2 s(0.00%)p1.00(99.98%)d0.00(0.02%)	1.988678406	-0.328111387 Hartree
11	BD(1)N1(Cl2) 1s(13.78%)p6.22(85.65%)d0.04(0.57%)	1.050753385	-0.306570453 Hartree
12	BD(1)Cl2(N1) 2s(9.72%)p9.21(89.51%)d0.08(0.78%)	0.948218675	-0.267876434 Hartree
13	BD(1)N1(H3) 1s(25.13%)p2.97(74.55%)d0.01(0.33%)	1.367790177	-0.315326389 Hartree
14	BD(1)H3(N1) 3s(99.94%)p0.00(0.06%)	0.636584789	0.064749684 Hartree
15	BD(1)N1(H4) 1s(25.13%)p2.97(74.55%)d0.01(0.33%)	1.367790177	-0.315326389 Hartree
16	BD(1)H4(N1) 4s(99.94%)p0.00(0.06%)	0.636584789	0.064749684 Hartree
17	RY(1)N1 s(20.52%)p0.98(20.17%)d2.89(59.32%)	0.001520526	0.811088300 Hartree
18	RY(2)N1 s(0.00%)p1.00(18.50%)d4.41(81.50%)	0.001505116	1.122315880 Hartree
19	RY(3)N1 s(40.71%)p1.03(41.74%)d0.43(17.55%)	0.000302734	1.455210322 Hartree
20	RY(4)N1 s(1.94%)p31.07(60.21%)d19.53(37.85%)	0.000003723	1.475081159 Hartree
21	RY(5)N1 s(8.30%)p10.15(84.25%)d0.90(7.45%)	0.000004151	1.802058577 Hartree
22	RY(6)N1 s(6.82%)p11.17(76.24%)d2.48(16.93%)	0.000000005	2.234743391 Hartree
23	RY(7)N1 s(22.71%)p2.49(56.53%)d0.91(20.76%)	0.000000000	4.021988388 Hartree
24	RY(8)N1 s(31.82%)p1.42(45.23%)d0.72(22.94%)	0.000000000	3.311761091 Hartree
25	RY(9)N1 s(18.28%)p3.44(62.92%)d1.03(18.79%)	0.000000000	7.423444516 Hartree
26	RY(10)N1 s(0.00%)p1.00(91.76%)d0.09(8.24%)	0.000000006	1.135457375 Hartree
27	RY(11)N1 s(12.58%)p5.64(70.91%)d1.31(16.52%)	0.000000000	3.033979095 Hartree
28	RY(12)N1 s(1.23%)p73.00(89.42%)d7.64(9.35%)	0.000000000	2.311997951 Hartree
29	RY(13)N1 s(23.41%)p1.67(39.06%)d1.60(37.52%)	0.000000000	2.462575623 Hartree
30	RY(14)N1 s(0.22%)p13.25(2.93%)d99.99(96.84%)	0.000000000	4.605847357 Hartree
31	RY(15)N1 s(1.22%)p11.06(13.52%)d69.72(85.26%)	0.000000000	2.175808339 Hartree
32	RY(16)N1 s(0.33%)p8.03(2.68%)d99.99(96.99%)	0.000000000	4.571088738 Hartree
33	RY(17)N1 s(37.48%)p1.28(47.87%)d0.39(14.66%)	0.000000000	13.170498259 Hartree
34	RY(18)N1 s(0.14%)p42.42(5.82%)d99.99(94.04%)	0.000000000	4.594046142 Hartree
35	RY(19)N1 s(3.01%)p14.08(42.41%)d18.12(54.58%)	0.000000000	2.191814123 Hartree
36	RY(20)N1 s(35.02%)p0.57(20.02%)d1.28(44.96%)	0.000000054	2.851281598 Hartree
37	RY(21)N1 s(33.57%)p0.21(7.18%)d1.77(59.25%)	0.000000000	11.518539004 Hartree
38	RY(22)N1 s(0.69%)p3.08(2.14%)d99.99(97.17%)	0.000000000	4.892830676 Hartree
39	RY(1)Cl2 s(2.11%)p13.80(29.12%)d32.58(68.77%)	0.006868185	0.647350087 Hartree
40	RY(2)Cl2 s(0.00%)p1.00(35.07%)d1.85(64.93%)	0.002514197	0.522866972 Hartree
41	RY(3)Cl2 s(16.06%)p4.62(74.17%)d0.61(9.77%)	0.000318269	0.664304999 Hartree
42	RY(4)Cl2 s(36.43%)p0.37(13.30%)d1.38(50.27%)	0.000004610	1.722901022 Hartree
43	RY(5)Cl2 s(5.35%)p5.01(26.76%)d12.70(67.90%)	0.000001169	1.957341508 Hartree
44	RY(6)Cl2 s(99.58%)p0.00(0.34%)d0.00(0.08%)	0.000000000	200.130860026 Hartree
45	RY(7)Cl2 s(1.46%)p56.22(82.23%)d11.15(16.31%)	0.000000000	6.898078532 Hartree
46	RY(8)Cl2 s(0.03%)p99.99(99.32%)d19.05(0.65%)	0.000000000	0.353593320 Hartree
47	RY(9)Cl2 s(0.34%)p99.99(97.04%)d7.81(2.62%)	0.000000000	20.120156935 Hartree
48	RY(10)Cl2 s(8.91%)p2.96(26.37%)d7.27(64.72%)	0.000000792	1.505537197 Hartree
49	RY(11)Cl2 s(14.24%)p5.83(83.02%)d0.19(2.74%)	0.000000001	21.493055251 Hartree
50	RY(12)Cl2 s(4.80%)p18.77(90.05%)d1.07(5.15%)	0.000000000	0.470168552 Hartree
51	RY(13)Cl2 s(0.74%)p70.36(51.76%)d64.58(47.51%)	0.000000000	2.161261981 Hartree
52	RY(14)Cl2 s(0.00%)p1.00(42.75%)d1.34(57.25%)	0.000000000	1.448452997 Hartree
53	RY(15)Cl2 s(0.00%)p1.00(95.41%)d0.05(4.59%)	0.000000000	8.987356750 Hartree
54	RY(16)Cl2 s(0.00%)p1.00(99.67%)d0.00(0.33%)	0.000000000	0.396263334 Hartree
55	RY(17)Cl2 s(0.00%)p1.00(96.98%)d0.03(3.02%)	0.000000000	18.100093387 Hartree
56	RY(18)Cl2 s(72.56%)p0.14(10.23%)d0.24(17.20%)	0.000000000	6.293303097 Hartree
57	RY(19)Cl2 s(25.24%)p1.56(39.41%)d1.40(35.35%)	0.000000631	2.664297374 Hartree
58	RY(20)Cl2 s(0.00%)p1.00(27.88%)d2.59(72.12%)	0.000001064	1.988735566 Hartree
59	RY(21)Cl2 s(0.00%)p1.00(1.93%)d50.79(98.07%)	0.000000000	0.526436357 Hartree
60	RY(22)Cl2 s(0.00%)p1.00(0.33%)d99.99(99.67%)	0.000000000	2.298104969 Hartree
61	RY(23)Cl2 s(79.93%)p0.19(14.80%)d0.07(5.27%)	0.000000000	12.538129278 Hartree
62	RY(24)Cl2 s(27.63%)p2.13(58.93%)d0.49(13.44%)	0.000000000	11.176333953 Hartree
63	RY(25)Cl2 s(2.42%)p0.42(1.01%)d39.94(96.57%)	0.000000000	0.824598798 Hartree
64	RY(26)Cl2 s(1.78%)p1.86(3.32%)d53.20(94.90%)	0.000000000	2.306504716 Hartree
65	RY(1)H3 s(87.22%)p0.15(12.78%)	0.001370476	0.712289166 Hartree
66	RY(2)H3 s(31.93%)p2.13(68.07%)	0.000495522	1.858756715 Hartree
67	RY(3)H3 s(32.15%)p2.11(67.85%)	0.000081913	1.889482277 Hartree
68	RY(4)H3 s(29.10%)p2.44(70.90%)	0.000006822	2.040065114 Hartree
69	RY(5)H3 s(19.66%)p4.09(80.34%)	0.000002458	2.283227740 Hartree
70	RY(1)H4 s(87.22%)p0.15(12.78%)	0.001370476	0.712289166 Hartree
71	RY(2)H4 s(31.93%)p2.13(68.07%)	0.000495522	1.858756715 Hartree
72	RY(3)H4 s(32.15%)p2.11(67.85%)	0.000081913	1.889482277 Hartree
73	RY(4)H4 s(29.10%)p2.44(70.90%)	0.000006822	2.040065113 Hartree
74	RY(5)H4 s(19.66%)p4.09(80.34%)	0.000002458	2.283227741 Hartree

Display Range		- / 74
Orbital	Description	NHOs	Occupancy	Energy	Actions
1	CR(1)N1	1	1.999991140	-14.374379566 Hartree
2	CR(1)Cl2	2	1.999999995	-101.408558528 Hartree
3	CR(2)Cl2	3	1.999991444	-9.643766489 Hartree
4	CR(3)Cl2	4	1.999998720	-7.235704455 Hartree
5	CR(4)Cl2	5	1.999998004	-7.249212736 Hartree
6	CR(5)Cl2	6	1.999998747	-7.236155947 Hartree
7	LP(1)N1	7	1.992333175	-0.395237133 Hartree
8	LP(1)Cl2	8	1.999402077	-0.719541258 Hartree
9	LP(2)Cl2	9	1.994926683	-0.343532549 Hartree
10	LP(3)Cl2	10	1.988678406	-0.328111387 Hartree
11	BD(1)N1-Cl2	11, 12	1.997067922	-0.605055765 Hartree
12	BD(1)N1-H3	13, 14	1.997039786	-0.633905343 Hartree
13	BD(1)N1-H4	15, 16	1.997039786	-0.633905343 Hartree
14	BD*(1)N1-Cl2		0.001904139	0.030608879 Hartree
15	BD*(1)N1-H3		0.007335180	0.383328638 Hartree
16	BD*(1)N1-H4		0.007335180	0.383328638 Hartree
17	RY(1)N1	17	0.001520526	0.811088300 Hartree
18	RY(2)N1	18	0.001505116	1.122315880 Hartree
19	RY(3)N1	19	0.000302734	1.455210322 Hartree
20	RY(4)N1	20	0.000003723	1.475081159 Hartree
21	RY(5)N1	21	0.000004151	1.802058577 Hartree
22	RY(6)N1	22	0.000000005	2.234743391 Hartree
23	RY(7)N1	23	0.000000000	4.021988388 Hartree
24	RY(8)N1	24	0.000000000	3.311761091 Hartree
25	RY(9)N1	25	0.000000000	7.423444516 Hartree
26	RY(10)N1	26	0.000000006	1.135457375 Hartree
27	RY(11)N1	27	0.000000000	3.033979095 Hartree
28	RY(12)N1	28	0.000000000	2.311997951 Hartree
29	RY(13)N1	29	0.000000000	2.462575623 Hartree
30	RY(14)N1	30	0.000000000	4.605847357 Hartree
31	RY(15)N1	31	0.000000000	2.175808339 Hartree
32	RY(16)N1	32	0.000000000	4.571088738 Hartree
33	RY(17)N1	33	0.000000000	13.170498259 Hartree
34	RY(18)N1	34	0.000000000	4.594046142 Hartree
35	RY(19)N1	35	0.000000000	2.191814123 Hartree
36	RY(20)N1	36	0.000000054	2.851281598 Hartree
37	RY(21)N1	37	0.000000000	11.518539004 Hartree
38	RY(22)N1	38	0.000000000	4.892830676 Hartree
39	RY(1)Cl2	39	0.006868185	0.647350087 Hartree
40	RY(2)Cl2	40	0.002514197	0.522866972 Hartree
41	RY(3)Cl2	41	0.000318269	0.664304999 Hartree
42	RY(4)Cl2	42	0.000004610	1.722901022 Hartree
43	RY(5)Cl2	43	0.000001169	1.957341508 Hartree
44	RY(6)Cl2	44	0.000000000	200.130860026 Hartree
45	RY(7)Cl2	45	0.000000000	6.898078532 Hartree
46	RY(8)Cl2	46	0.000000000	0.353593320 Hartree
47	RY(9)Cl2	47	0.000000000	20.120156935 Hartree
48	RY(10)Cl2	48	0.000000792	1.505537197 Hartree
49	RY(11)Cl2	49	0.000000001	21.493055251 Hartree
50	RY(12)Cl2	50	0.000000000	0.470168552 Hartree
51	RY(13)Cl2	51	0.000000000	2.161261981 Hartree
52	RY(14)Cl2	52	0.000000000	1.448452997 Hartree
53	RY(15)Cl2	53	0.000000000	8.987356750 Hartree
54	RY(16)Cl2	54	0.000000000	0.396263334 Hartree
55	RY(17)Cl2	55	0.000000000	18.100093387 Hartree
56	RY(18)Cl2	56	0.000000000	6.293303097 Hartree
57	RY(19)Cl2	57	0.000000631	2.664297374 Hartree
58	RY(20)Cl2	58	0.000001064	1.988735566 Hartree
59	RY(21)Cl2	59	0.000000000	0.526436357 Hartree
60	RY(22)Cl2	60	0.000000000	2.298104969 Hartree
61	RY(23)Cl2	61	0.000000000	12.538129278 Hartree
62	RY(24)Cl2	62	0.000000000	11.176333953 Hartree
63	RY(25)Cl2	63	0.000000000	0.824598798 Hartree
64	RY(26)Cl2	64	0.000000000	2.306504716 Hartree
65	RY(1)H3	65	0.001370476	0.712289166 Hartree
66	RY(2)H3	66	0.000495522	1.858756715 Hartree
67	RY(3)H3	67	0.000081913	1.889482277 Hartree
68	RY(4)H3	68	0.000006822	2.040065114 Hartree
69	RY(5)H3	69	0.000002458	2.283227740 Hartree
70	RY(1)H4	70	0.001370476	0.712289166 Hartree
71	RY(2)H4	71	0.000495522	1.858756715 Hartree
72	RY(3)H4	72	0.000081913	1.889482277 Hartree
73	RY(4)H4	73	0.000006822	2.040065113 Hartree
74	RY(5)H4	74	0.000002458	2.283227741 Hartree

Ideas are like rabbits. You get a couple and learn how to handle them, and pretty soon you have a dozen. -- John Steinbeck