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• 2024.9.3
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• atom.csv

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resources.forcefield.mmff94.atom.csv Maven / Gradle / Ivy

95
int,int,int,int,int,int,int,int,int
1,6,4,4,0,0,0,0,0
2,6,3,4,0,2,0,0,1
3,6,3,4,0,2,0,0,1
4,6,2,4,0,3,0,1,1
5,1,1,1,0,0,0,0,0
6,8,2,2,1,0,0,0,0
7,8,1,2,0,2,0,0,0
8,7,3,3,1,0,0,0,0
9,7,2,3,0,2,0,0,1
10,7,3,3,1,1,0,0,0
11,9,1,1,1,0,0,0,0
12,17,1,1,1,0,0,0,0
13,35,1,1,1,0,0,0,0
14,53,1,1,1,0,0,0,0
15,16,2,2,1,0,0,0,0
16,16,1,2,0,2,0,0,0
17,16,3,4,0,2,0,0,0
18,16,4,4,0,0,0,0,0
19,14,4,4,0,0,0,0,0
20,6,4,4,0,0,0,0,0
21,1,1,1,0,0,0,0,0
22,6,4,4,0,0,0,0,0
23,1,1,1,0,0,0,0,0
24,1,1,1,0,0,0,0,0
25,15,4,4,0,0,0,0,0
26,15,3,3,1,0,0,0,0
27,1,1,1,0,0,0,0,0
28,1,1,1,0,0,0,0,0
29,1,1,1,0,0,0,0,0
30,6,3,4,0,2,0,0,1
31,1,1,1,0,0,0,0,0
32,8,1,12,1,1,0,0,0
33,1,1,1,0,0,0,0,0
34,7,4,4,0,0,0,0,0
35,8,1,1,1,1,0,0,0
36,1,1,1,0,0,0,0,0
37,6,3,4,0,2,1,0,1
38,7,2,3,0,2,1,0,0
39,7,3,3,1,1,1,0,1
40,7,3,3,1,0,0,0,0
41,6,3,4,0,1,0,0,0
42,7,1,3,0,3,0,0,0
43,7,3,3,1,0,0,0,0
44,16,2,2,1,1,1,0,0
45,7,3,4,0,2,0,0,0
46,7,2,3,0,2,0,0,0
47,7,1,2,0,2,0,0,0
48,7,2,2,0,0,0,0,0
49,8,3,3,0,0,0,0,0
50,1,1,1,0,0,0,0,0
51,8,2,3,0,2,0,0,0
52,1,1,1,0,0,0,0,0
53,7,2,4,0,2,0,1,0
54,7,3,4,0,2,0,0,1
55,7,3,34,0,1,0,0,0
56,7,3,34,0,1,0,0,0
57,6,3,4,0,2,0,0,1
58,7,3,4,0,1,1,0,1
59,8,2,2,1,1,1,0,0
60,6,1,3,0,3,0,0,0
61,7,2,4,0,3,0,1,0
62,7,2,2,1,0,0,0,0
63,6,3,4,0,2,1,0,1
64,6,3,4,0,2,1,0,1
65,7,2,3,0,2,1,0,0
66,7,2,3,0,2,1,0,0
67,7,3,4,0,2,0,0,1
68,7,4,4,0,0,0,0,0
69,7,3,4,0,1,1,0,0
70,8,2,2,1,0,0,0,0
71,1,1,1,0,0,0,0,0
72,16,1,1,1,1,0,0,0
73,16,3,3,0,0,0,0,0
74,16,2,4,0,2,0,0,0
75,15,2,3,0,2,0,0,1
76,7,2,2,1,0,0,0,0
77,17,4,4,0,0,0,0,0
78,6,3,4,0,2,1,0,1
79,7,2,3,0,2,1,0,0
80,6,3,4,0,2,0,0,1
81,7,3,4,0,1,1,0,1
82,7,3,4,0,1,1,0,0
87,26,0,0,0,0,0,0,0
88,26,0,0,0,0,0,0,0
89,9,0,0,0,0,0,0,0
90,17,0,0,0,0,0,0,0
91,35,0,0,0,0,0,0,0
92,3,0,0,0,0,0,0,0
93,11,0,0,0,0,0,0,0
94,19,0,0,0,0,0,0,0
95,30,0,0,0,0,0,0,0
96,20,0,0,0,0,0,0,0
97,29,0,0,0,0,0,0,0
98,29,0,0,0,0,0,0,0
99,12,0,0,0,0,0,0,0