1.1 --- /dev/null	Thu Jan 01 00:00:00 1970 +0000
     1.2 +++ b/Orig/Molecules.txt	Tue Nov 22 08:15:16 2016 +0100
     1.3 @@ -0,0 +1,90 @@
     1.4 +10	3.42778e-06
     1.5 +11	3.71333e-06
     1.6 +12	3.69259e-06
     1.7 +13	3.49697e-06
     1.8 +14	4.1619e-06
     1.9 +15	3.6e-06
    1.10 +16	4.37724e-06
    1.11 +17	4.88684e-06
    1.12 +18	5.33871e-06
    1.13 +19	5.08736e-06
    1.14 +20	5.35466e-06
    1.15 +21	5.50116e-06
    1.16 +22	5.80731e-06
    1.17 +23	5.90647e-06
    1.18 +24	5.93047e-06
    1.19 +25	6.06842e-06
    1.20 +26	6.1179e-06
    1.21 +27	6.44147e-06
    1.22 +28	6.56762e-06
    1.23 +29	6.77202e-06
    1.24 +30	6.75974e-06
    1.25 +31	7.01752e-06
    1.26 +32	7.04533e-06
    1.27 +33	8.7624e-06
    1.28 +34	8.86917e-06
    1.29 +35	8.94772e-06
    1.30 +36	9.30342e-06
    1.31 +37	9.56321e-06
    1.32 +38	9.81248e-06
    1.33 +39	9.56932e-06
    1.34 +40	9.88529e-06
    1.35 +41	9.64596e-06
    1.36 +42	1.07429e-05
    1.37 +43	1.07565e-05
    1.38 +44	1.07412e-05
    1.39 +45	1.17128e-05
    1.40 +46	1.13302e-05
    1.41 +47	1.13397e-05
    1.42 +48	1.19375e-05
    1.43 +49	1.18611e-05
    1.44 +50	1.12904e-05
    1.45 +51	1.19178e-05
    1.46 +52	1.28643e-05
    1.47 +53	1.26859e-05
    1.48 +54	1.30195e-05
    1.49 +55	1.31267e-05
    1.50 +56	1.23778e-05
    1.51 +57	1.23053e-05
    1.52 +58	1.34734e-05
    1.53 +59	1.60745e-05
    1.54 +60	1.48468e-05
    1.55 +61	1.86284e-05
    1.56 +62	2.12943e-05
    1.57 +63	1.65082e-05
    1.58 +64	1.50432e-05
    1.59 +65	2.29603e-05
    1.60 +66	2.34885e-05
    1.61 +67	2.07329e-05
    1.62 +68	1.83923e-05
    1.63 +69	2.0017e-05
    1.64 +70	2.06778e-05
    1.65 +71	1.94381e-05
    1.66 +72	1.92758e-05
    1.67 +73	2.03875e-05
    1.68 +74	1.88409e-05
    1.69 +75	2.05361e-05
    1.70 +76	2.19068e-05
    1.71 +77	2.08409e-05
    1.72 +78	2.06861e-05
    1.73 +79	2.16962e-05
    1.74 +80	2.20512e-05
    1.75 +81	2.53083e-05
    1.76 +82	2.43393e-05
    1.77 +83	2.435e-05
    1.78 +84	2.51667e-05
    1.79 +85	3.00069e-05
    1.80 +86	2.56722e-05
    1.81 +87	2.5725e-05
    1.82 +88	2.59167e-05
    1.83 +89	2.23433e-05
    1.84 +90	2.60361e-05
    1.85 +91	2.45929e-05
    1.86 +92	2.77e-05
    1.87 +93	2.64333e-05
    1.88 +94	2.56e-05
    1.89 +95	2.33389e-05
    1.90 +96	2.634e-05
    1.91 +97	2.60458e-05
    1.92 +98	2.9175e-05
    1.93 +99	2.265e-05