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X-MOL_dict
112 lines (112 loc) · 872 Bytes
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X-MOL_dict
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[PAD] 0
[CLS] 1
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[MASK] 3
# 4
%10 5
%11 6
%12 7
%13 8
( 9
) 10
- 11
/ 12
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= 22
B 23
Br 24
C 25
Cl 26
F 27
I 28
N 29
O 30
P 31
S 32
c 33
n 34
o 35
p 36
s 37
[17O] 38
[18OH] 39
[B-] 40
[B@-] 41
[B@@-] 42
[BH-] 43
[BH2-] 44
[BH3-] 45
[Br+] 46
[C+] 47
[C-] 48
[C@@H] 49
[C@@] 50
[C@H] 51
[C@] 52
[CH-] 53
[CH2-] 54
[CH2] 55
[CH] 56
[C] 57
[I+] 58
[IH2] 59
[N+] 60
[N-] 61
[N@+] 62
[N@@+] 63
[N@@H+] 64
[N@H+] 65
[NH+] 66
[NH] 67
[N] 68
[O+] 69
[O-] 70
[O] 71
[P+] 72
[P@+] 73
[P@@+] 74
[P@@H] 75
[P@@] 76
[P@H] 77
[P@] 78
[PH] 79
[S+] 80
[S@+] 81
[S@@+] 82
[S@@H] 83
[S@@] 84
[S@H] 85
[S@] 86
[SH3] 87
[SH] 88
[Si-] 89
[Si] 90
[Sn+2] 91
[Sn+3] 92
[Sn+] 93
[Sn-] 94
[SnH2+] 95
[SnH2] 96
[SnH4+2] 97
[SnH6+3] 98
[SnH] 99
[Sn] 100
[c-] 101
[cH-] 102
[c] 103
[n+] 104
[nH] 105
[o+] 106
[p+] 107
[s+] 108
[si] 109
\ 110
[UNK] 111