org.openscience.cdk.config.data.whim_weights.txt Maven / Gradle / Ivy

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Symbol	Mass	VdWVolume	Electronegativity	Polarizability
H	1.01	6.71	2.59	0.67
B	10.81	17.88	2.28	3.03
C	12.01	22.45	2.75	1.76
N	14.01	15.6	3.19	1.1
O	16	11.49	3.65	0.8
F	19	9.2	4	0.56
Al	26.98	36.51	1.71	6.8
Si	28.09	31.98	2.14	5.38
P	30.97	26.52	2.52	3.63
S	32.07	24.43	2.96	2.9
Cl	35.45	22.45	3.48	2.18
Cr	52	44.6	1.66	11.6
Mn	54.94	43.4	2.2	9.4
Fe	55.85	41.05	2.2	8.4
Co	58.93	35.04	2.56	7.5
Ni	58.69	17.16	1.94	6.8
Cu	63.55	11.49	1.98	6.1
Zn	65.39	11.25	2.23	7.1
Ga	69.72	27.39	2.42	8.12
Ge	72.61	28.73	2.62	6.07
As	74.92	26.52	2.82	4.31
Se	78.96	28.73	3.01	3.77
Br	79.9	31.06	3.22	3.05
Mo	95.94	33.51	1.15	12.8
Ag	107.87	21.31	1.83	7.2
Cd	112.41	16.52	1.98	7.2
In	114.82	30.11	2.14	10.2
Sn	118.71	45.83	2.3	7.7
Sb	121.76	38.79	2.46	6.6
Te	127.6	36.62	2.62	5.5
I	126.9	38.79	2.78	5.35
Gd	157.25	72.78	2	23.5
Pt	195.08	22.45	2.28	6.5
Au	196.97	19.16	2.54	5.8
Hg	200.59	15.6	2.2	5.7
Tl	204.38	31.54	2.25	7.6
Pb	207.2	34.53	2.29	6.8
Bi	208.98	38.79	2.34	7.4