Hugging Face's logo

RaphaelMourad
/
Mistral-Chem-v1-417M

Text Generation
Transformers
Safetensors
mixtral
pretrained
mistral
chemistry
text-generation-inference
Inference Endpoints
Model card Files Community
RaphaelMourad commited on
Commit
b73509e
•
1 Parent(s): bd49ca1

Upload 9 files

Browse files
Files changed (9) hide show
  1. config.json +31 -0
  2. generation_config.json +6 -0
  3. model.safetensors +3 -0
  4. rng_state.pth +3 -0
  5. scheduler.pt +3 -0
  6. tokenizer.json +2080 -0
  7. tokenizer_config.json +52 -0
  8. trainer_state.json +0 -0
  9. training_args.bin +3 -0
config.json ADDED
@@ -0,0 +1,31 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "_name_or_path": "data/models/Mixtral-8x7B-v0.4-chem",
3
+ "architectures": [
4
+ "MixtralForCausalLM"
5
+ ],
6
+ "attention_dropout": 0.0,
7
+ "bos_token_id": 1,
8
+ "eos_token_id": 2,
9
+ "hidden_act": "silu",
10
+ "hidden_size": 768,
11
+ "initializer_range": 0.02,
12
+ "intermediate_size": 2688,
13
+ "max_position_embeddings": 512,
14
+ "model_type": "mixtral",
15
+ "num_attention_heads": 8,
16
+ "num_experts_per_tok": 1,
17
+ "num_hidden_layers": 8,
18
+ "num_key_value_heads": 8,
19
+ "num_local_experts": 8,
20
+ "output_router_logits": false,
21
+ "rms_norm_eps": 1e-05,
22
+ "rope_theta": 1000000.0,
23
+ "router_aux_loss_coef": 0.02,
24
+ "router_jitter_noise": 0.0,
25
+ "sliding_window": null,
26
+ "tie_word_embeddings": false,
27
+ "torch_dtype": "bfloat16",
28
+ "transformers_version": "4.40.2",
29
+ "use_cache": true,
30
+ "vocab_size": 1024
31
+ }
generation_config.json ADDED
@@ -0,0 +1,6 @@
 
 
 
 
 
 
 
1
+ {
2
+ "_from_model_config": true,
3
+ "bos_token_id": 1,
4
+ "eos_token_id": 2,
5
+ "transformers_version": "4.40.2"
6
+ }
model.safetensors ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:cf43584dc0ac37dd0eb96c813a98c5e81c30461293ce248afd739a1a8ad9bb9b
3
+ size 833773320
rng_state.pth ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:8d3b7102895eb0637b0cab516bd672f216b2bf79078a83eb301011a90444f44c
3
+ size 14244
scheduler.pt ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:62957a99306093236e75102c7f2f49202c21dbd6628017dd280628e7b4e2cc60
3
+ size 1064
tokenizer.json ADDED
@@ -0,0 +1,2080 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "version": "1.0",
3
+ "truncation": null,
4
+ "padding": null,
5
+ "added_tokens": [
6
+ {
7
+ "id": 0,
8
+ "content": "[UNK]",
9
+ "single_word": false,
10
+ "lstrip": false,
11
+ "rstrip": false,
12
+ "normalized": false,
13
+ "special": true
14
+ },
15
+ {
16
+ "id": 1,
17
+ "content": "[CLS]",
18
+ "single_word": false,
19
+ "lstrip": false,
20
+ "rstrip": false,
21
+ "normalized": false,
22
+ "special": true
23
+ },
24
+ {
25
+ "id": 2,
26
+ "content": "[SEP]",
27
+ "single_word": false,
28
+ "lstrip": false,
29
+ "rstrip": false,
30
+ "normalized": false,
31
+ "special": true
32
+ },
33
+ {
34
+ "id": 3,
35
+ "content": "[PAD]",
36
+ "single_word": false,
37
+ "lstrip": false,
38
+ "rstrip": false,
39
+ "normalized": false,
40
+ "special": true
41
+ },
42
+ {
43
+ "id": 4,
44
+ "content": "[MASK]",
45
+ "single_word": false,
46
+ "lstrip": false,
47
+ "rstrip": false,
48
+ "normalized": false,
49
+ "special": true
50
+ }
51
+ ],
52
+ "normalizer": null,
53
+ "pre_tokenizer": {
54
+ "type": "Whitespace"
55
+ },
56
+ "post_processor": null,
57
+ "decoder": null,
58
+ "model": {
59
+ "type": "BPE",
60
+ "dropout": null,
61
+ "unk_token": "[UNK]",
62
+ "continuing_subword_prefix": null,
63
+ "end_of_word_suffix": null,
64
+ "fuse_unk": false,
65
+ "byte_fallback": false,
66
+ "vocab": {
67
+ "[UNK]": 0,
68
+ "[CLS]": 1,
69
+ "[SEP]": 2,
70
+ "[PAD]": 3,
71
+ "[MASK]": 4,
72
+ "#": 5,
73
+ "(": 6,
74
+ ")": 7,
75
+ "+": 8,
76
+ "-": 9,
77
+ "/": 10,
78
+ "1": 11,
79
+ "2": 12,
80
+ "3": 13,
81
+ "4": 14,
82
+ "5": 15,
83
+ "6": 16,
84
+ "7": 17,
85
+ "8": 18,
86
+ "=": 19,
87
+ "@": 20,
88
+ "B": 21,
89
+ "C": 22,
90
+ "F": 23,
91
+ "H": 24,
92
+ "I": 25,
93
+ "N": 26,
94
+ "O": 27,
95
+ "P": 28,
96
+ "S": 29,
97
+ "[": 30,
98
+ "\\": 31,
99
+ "]": 32,
100
+ "c": 33,
101
+ "l": 34,
102
+ "n": 35,
103
+ "o": 36,
104
+ "r": 37,
105
+ "s": 38,
106
+ "cc": 39,
107
+ "CC": 40,
108
+ "c1": 41,
109
+ "(=": 42,
110
+ "c2": 43,
111
+ "c1cc": 44,
112
+ "](": 45,
113
+ "@@": 46,
114
+ "NC": 47,
115
+ "c2cc": 48,
116
+ "c3": 49,
117
+ "CCC": 50,
118
+ "c1ccc": 51,
119
+ ")[": 52,
120
+ "cc1": 53,
121
+ "NH": 54,
122
+ "+]": 55,
123
+ "c1cccc": 56,
124
+ "CO": 57,
125
+ "1CC": 58,
126
+ "c2cccc": 59,
127
+ "n1": 60,
128
+ "Cl": 61,
129
+ "nc": 62,
130
+ "C1": 63,
131
+ "c3cc": 64,
132
+ "2CC": 65,
133
+ "OC": 66,
134
+ "CC1": 67,
135
+ "c2ccc": 68,
136
+ "c2ccccc2": 69,
137
+ "c1ccccc1": 70,
138
+ ")(": 71,
139
+ "(-": 72,
140
+ "CN": 73,
141
+ "([": 74,
142
+ "cc2": 75,
143
+ "n2": 76,
144
+ "-]": 77,
145
+ ")(=": 78,
146
+ "1C": 79,
147
+ "nH": 80,
148
+ "C2": 81,
149
+ "CC2": 82,
150
+ "c1n": 83,
151
+ "1CCC": 84,
152
+ "c3cccc": 85,
153
+ "-])": 86,
154
+ "c1c": 87,
155
+ "c2c": 88,
156
+ "Cc1ccc": 89,
157
+ "+](": 90,
158
+ "NH2": 91,
159
+ "CCO": 92,
160
+ ")=": 93,
161
+ "c3ccccc3": 94,
162
+ "2C": 95,
163
+ "CCN": 96,
164
+ "c4": 97,
165
+ "Cc1cc": 98,
166
+ "N1CC": 99,
167
+ "nn": 100,
168
+ "COc1ccc": 101,
169
+ "2CCC": 102,
170
+ "s1": 103,
171
+ "Br": 104,
172
+ "CNC": 105,
173
+ "CS": 106,
174
+ "c3ccc": 107,
175
+ "N2CC": 108,
176
+ "c2n": 109,
177
+ "ccc1": 110,
178
+ "+](=": 111,
179
+ "c1nc": 112,
180
+ "COC": 113,
181
+ "o1": 114,
182
+ "cc3": 115,
183
+ "3CC": 116,
184
+ "c1C": 117,
185
+ "nc2": 118,
186
+ "cccc": 119,
187
+ "NCC": 120,
188
+ "C1CC": 121,
189
+ "nc1": 122,
190
+ "n3": 123,
191
+ "c3c": 124,
192
+ "+][": 125,
193
+ "Nc1ccc": 126,
194
+ "ccc": 127,
195
+ "Cc1n": 128,
196
+ "CC3": 129,
197
+ "]([": 130,
198
+ "NH3": 131,
199
+ "s2": 132,
200
+ "Cc1c": 133,
201
+ "c2nc": 134,
202
+ "Cn1": 135,
203
+ "ccc2": 136,
204
+ "Cc1cccc": 137,
205
+ "sc": 138,
206
+ "C2CC": 139,
207
+ "N1CCC": 140,
208
+ "C3": 141,
209
+ "OCC": 142,
210
+ "CCC1": 143,
211
+ "1CCN": 144,
212
+ "o2": 145,
213
+ "COc1cc": 146,
214
+ "(/": 147,
215
+ "Cc1ccccc1": 148,
216
+ "CCC2": 149,
217
+ "@]": 150,
218
+ "CCOC": 151,
219
+ "@@]": 152,
220
+ "oc": 153,
221
+ "CCNC": 154,
222
+ "O1": 155,
223
+ "N1C": 156,
224
+ "cc1C": 157,
225
+ "CCn1": 158,
226
+ "Nc1cc": 159,
227
+ "+])": 160,
228
+ "N1CCN": 161,
229
+ "N2CCC": 162,
230
+ "c2ccccc21": 163,
231
+ ")/": 164,
232
+ "c4cccc": 165,
233
+ "N2C": 166,
234
+ "Nc2ccc": 167,
235
+ "N3": 168,
236
+ "Nc1cccc": 169,
237
+ "CCCC": 170,
238
+ "SC": 171,
239
+ "COc1cccc": 172,
240
+ "Cc1nc": 173,
241
+ "ncc": 174,
242
+ "n2c": 175,
243
+ "1CN": 176,
244
+ "c2c1": 177,
245
+ "N1": 178,
246
+ "SCC": 179,
247
+ "C2CC2": 180,
248
+ "cc1F": 181,
249
+ "nc3": 182,
250
+ "COc1ccccc1": 183,
251
+ "c4ccccc4": 184,
252
+ "Cc2ccc": 185,
253
+ "cn1": 186,
254
+ "c12": 187,
255
+ "cc1Cl": 188,
256
+ "Cc2ccccc2": 189,
257
+ "CCS": 190,
258
+ "c1nnc": 191,
259
+ "3C": 192,
260
+ "CCCO": 193,
261
+ "1CCCC": 194,
262
+ "C1CC1": 195,
263
+ "c1ccc2c": 196,
264
+ "nn1": 197,
265
+ "1CCCN": 198,
266
+ "N2CCN": 199,
267
+ "c1ncc": 200,
268
+ "CCC3": 201,
269
+ "c2C": 202,
270
+ "NNC": 203,
271
+ "c2ncc": 204,
272
+ "Nc1ccccc1": 205,
273
+ "CCOc1ccc": 206,
274
+ "OCO": 207,
275
+ "CCN1C": 208,
276
+ "@](": 209,
277
+ "cc1OC": 210,
278
+ "no1": 211,
279
+ "OCC2": 212,
280
+ "OCC1": 213,
281
+ "NS": 214,
282
+ "N2": 215,
283
+ "Nc2cc": 216,
284
+ "nn2": 217,
285
+ "O2": 218,
286
+ "c3nc": 219,
287
+ "Cn1c": 220,
288
+ "CN1C": 221,
289
+ "@@](": 222,
290
+ "cc1NC": 223,
291
+ "OCCO": 224,
292
+ "=[": 225,
293
+ "N3CC": 226,
294
+ "c2nnc": 227,
295
+ "2CCCC": 228,
296
+ "CCc1ccc": 229,
297
+ "cs1": 230,
298
+ "CN2CC": 231,
299
+ "NCc1ccc": 232,
300
+ "n2cc": 233,
301
+ "c4ccc": 234,
302
+ "s3": 235,
303
+ "C3CC": 236,
304
+ "c3ccccc32": 237,
305
+ "ncc2": 238,
306
+ "NCCC": 239,
307
+ "c23": 240,
308
+ "Cn1cc": 241,
309
+ "c1nn": 242,
310
+ "c2cccs2": 243,
311
+ "CCn1c": 244,
312
+ "Nc2cccc": 245,
313
+ "c1cccs1": 246,
314
+ "ccc3": 247,
315
+ "Nc2ccccc2": 248,
316
+ "o3": 249,
317
+ "Cc1nn": 250,
318
+ "1CCO": 251,
319
+ "c2ccccc12": 252,
320
+ "Cc1": 253,
321
+ "c2ccc3c": 254,
322
+ "sc1": 255,
323
+ "c3n": 256,
324
+ "c1cc2": 257,
325
+ "n1C": 258,
326
+ "CCCC2": 259,
327
+ "ncc1": 260,
328
+ "1CC1": 261,
329
+ "1CCCO1": 262,
330
+ "n1c": 263,
331
+ "1NC": 264,
332
+ "c2cccnc2": 265,
333
+ "+]([": 266,
334
+ "Cc2c": 267,
335
+ "c2ccco2": 268,
336
+ "N2CCOCC2": 269,
337
+ "1CCCC1": 270,
338
+ "n2C": 271,
339
+ "NN": 272,
340
+ "c1ccco1": 273,
341
+ "3CCC": 274,
342
+ "CCO1": 275,
343
+ "c2nn": 276,
344
+ "c4c": 277,
345
+ "cccc2": 278,
346
+ "Cc3ccccc3": 279,
347
+ "ccc21": 280,
348
+ "C1CCN": 281,
349
+ "N1CCOCC1": 282,
350
+ "Nc1c": 283,
351
+ "cc4": 284,
352
+ "CCCNC": 285,
353
+ "N2CCCC2": 286,
354
+ "Cc2cc": 287,
355
+ "+]=": 288,
356
+ "c1nc2ccccc2": 289,
357
+ "2CCCO2": 290,
358
+ "1CCS": 291,
359
+ "1CO": 292,
360
+ "2CCN": 293,
361
+ "C3CC3": 294,
362
+ "1CCCCC1": 295,
363
+ "cc2C": 296,
364
+ "-])[": 297,
365
+ "Cc2cccc": 298,
366
+ "C4": 299,
367
+ "NC1": 300,
368
+ "Cc1noc": 301,
369
+ "OC2": 302,
370
+ "Oc1ccc": 303,
371
+ "c2ccccc2C": 304,
372
+ "c2ccccc2F": 305,
373
+ "CCCC1": 306,
374
+ "Cc1csc": 307,
375
+ "c1ccccc1F": 308,
376
+ "2CCCC2": 309,
377
+ "CCCN": 310,
378
+ "c2ccccc2c1": 311,
379
+ "1O": 312,
380
+ "NC2": 313,
381
+ "c1ccccc1C": 314,
382
+ "ccc1C": 315,
383
+ "1c1ccc": 316,
384
+ "c1ccccn1": 317,
385
+ "ccc12": 318,
386
+ "ccc1F": 319,
387
+ "cn2": 320,
388
+ "n4": 321,
389
+ "c2nc3ccccc3": 322,
390
+ "cccn2": 323,
391
+ "c1OC": 324,
392
+ "c1cn": 325,
393
+ "nc12": 326,
394
+ "CCOCC3": 327,
395
+ "c1cccc2": 328,
396
+ "c2cc3": 329,
397
+ "no2": 330,
398
+ "c1ccccc1Cl": 331,
399
+ "c1ccncc1": 332,
400
+ "CC4": 333,
401
+ "2CCCN": 334,
402
+ "nc1C": 335,
403
+ "OCO2": 336,
404
+ "sc2": 337,
405
+ "c1ccccc1NC": 338,
406
+ "n1cc": 339,
407
+ "OCCO2": 340,
408
+ "CN2C": 341,
409
+ "c1cccnc1": 342,
410
+ "n2nc": 343,
411
+ "Cc3ccc": 344,
412
+ "2CCCCC2": 345,
413
+ "c2ccccc2Cl": 346,
414
+ "c5": 347,
415
+ "S1": 348,
416
+ "c2ccccn2": 349,
417
+ "c2cnn": 350,
418
+ "C1C": 351,
419
+ "nnc1": 352,
420
+ "CCCC3": 353,
421
+ "c1NC": 354,
422
+ "sc1C": 355,
423
+ "CCn1cc": 356,
424
+ "nc4": 357,
425
+ "Nc3ccc": 358,
426
+ "2CC2": 359,
427
+ "cc12": 360,
428
+ "c2s": 361,
429
+ "c2ccncc2": 362,
430
+ "Nc1ccc2c": 363,
431
+ "Nc1nc": 364,
432
+ "(\\": 365,
433
+ "cc2Cl": 366,
434
+ "COCC": 367,
435
+ "cc21": 368,
436
+ "cc2F": 369,
437
+ "c3ccccc23": 370,
438
+ "nc2c1": 371,
439
+ "on1": 372,
440
+ "c2cn": 373,
441
+ "c1csc": 374,
442
+ "c1cnc": 375,
443
+ "2C1": 376,
444
+ "N1CCCC1": 377,
445
+ "cs2": 378,
446
+ "ccc1Cl": 379,
447
+ "ccc1NC": 380,
448
+ "c1noc": 381,
449
+ "N3CCC": 382,
450
+ "CN1CC": 383,
451
+ "N4": 384,
452
+ "ccc1OC": 385,
453
+ "Cc1ncc": 386,
454
+ "NCc2ccc": 387,
455
+ ")([": 388,
456
+ "c3cccs3": 389,
457
+ "C1CCCC1": 390,
458
+ "c1F": 391,
459
+ "21": 392,
460
+ "sc2c1": 393,
461
+ "OCO3": 394,
462
+ "CCc1nn": 395,
463
+ "n3c": 396,
464
+ "32": 397,
465
+ "C1CCC": 398,
466
+ "C1CCCCC1": 399,
467
+ "CNS": 400,
468
+ "ncc3": 401,
469
+ "CN1CCN": 402,
470
+ "2c": 403,
471
+ "CCCO3": 404,
472
+ "nn1C": 405,
473
+ "@@](=": 406,
474
+ "c2ccccc2C1": 407,
475
+ "2CO": 408,
476
+ "CCCCC": 409,
477
+ "c3ccc4c": 410,
478
+ "c1cnn": 411,
479
+ "Cc1ccc2c": 412,
480
+ "CCO2": 413,
481
+ "c1O": 414,
482
+ "c3c2": 415,
483
+ "N3CCCC3": 416,
484
+ "CCOc1cc": 417,
485
+ "CSC": 418,
486
+ "CCc1cc": 419,
487
+ "cccc3": 420,
488
+ "c2csc": 421,
489
+ "c2noc": 422,
490
+ "Cn2c": 423,
491
+ "cc1S": 424,
492
+ "c3ccccc3C": 425,
493
+ "ccccc4": 426,
494
+ "c3cccnc3": 427,
495
+ "COc1ccc2c": 428,
496
+ "Cc1nnc": 429,
497
+ "c1Cl": 430,
498
+ "N2CCCCC2": 431,
499
+ "ccccc2": 432,
500
+ "Oc2ccc": 433,
501
+ "2CN": 434,
502
+ "c1s": 435,
503
+ "-])=": 436,
504
+ "C2CCN": 437,
505
+ "c3ncc": 438,
506
+ "c3C": 439,
507
+ "c3ccco3": 440,
508
+ "@](=": 441,
509
+ "Nc2nc": 442,
510
+ "ncn2": 443,
511
+ "N3CCOCC3": 444,
512
+ "c3nc4": 445,
513
+ "1S": 446,
514
+ "COc2ccc": 447,
515
+ "nc2ccccc21": 448,
516
+ "n2cccn2": 449,
517
+ "ccc2C": 450,
518
+ "c1cc2c": 451,
519
+ "no": 452,
520
+ "3CCCC": 453,
521
+ "cc2c1": 454,
522
+ "n12": 455,
523
+ "1c1ccccc1": 456,
524
+ "ccc1O": 457,
525
+ "Nc1n": 458,
526
+ "cc1Br": 459,
527
+ "C2C": 460,
528
+ "/[": 461,
529
+ "N3C": 462,
530
+ "c3ccccn3": 463,
531
+ "c1N": 464,
532
+ "CSc1ccc": 465,
533
+ "c1cncc": 466,
534
+ "OCCO3": 467,
535
+ "ccccc12": 468,
536
+ "CCCCC2": 469,
537
+ "2CCS": 470,
538
+ "c3ccccc3c2": 471,
539
+ "C2CCCC2": 472,
540
+ "3CCCO3": 473,
541
+ "c2sc": 474,
542
+ "CCCCC1": 475,
543
+ "nnn1": 476,
544
+ "ccccc3": 477,
545
+ "C2CCCCC2": 478,
546
+ "cccn1": 479,
547
+ "N3CCN": 480,
548
+ "3C2": 481,
549
+ "c3ccccc3F": 482,
550
+ "CN2CCN": 483,
551
+ "2CCO": 484,
552
+ "cccn3": 485,
553
+ "CSCC": 486,
554
+ "c2cnc": 487,
555
+ "CCn1nc": 488,
556
+ "OC3": 489,
557
+ "2O": 490,
558
+ "NCC1": 491,
559
+ "Cc1cnc": 492,
560
+ "c3nnc": 493,
561
+ "N1CCCCC1": 494,
562
+ "CCN2C": 495,
563
+ "CCc1nc": 496,
564
+ "N1CCO": 497,
565
+ "n1CC": 498,
566
+ "nn3": 499,
567
+ "Cn1nc": 500,
568
+ "S2": 501,
569
+ "n3cc": 502,
570
+ "cc1O": 503,
571
+ "c1nccs1": 504,
572
+ "c2cccc3": 505,
573
+ "CCOc1ccccc1": 506,
574
+ "oc1": 507,
575
+ "CCc1ccccc1": 508,
576
+ "ncn1": 509,
577
+ "c4cc": 510,
578
+ "CSc1nnc": 511,
579
+ "CCc1cccc": 512,
580
+ "Cc1cccs1": 513,
581
+ "12": 514,
582
+ "NCc1cc": 515,
583
+ "nc2C": 516,
584
+ "1CCCN1C": 517,
585
+ "3CCCC3": 518,
586
+ "n3C": 519,
587
+ "CCOc1cccc": 520,
588
+ "Nc2c": 521,
589
+ "2CCCN2C": 522,
590
+ "sc3": 523,
591
+ "+])[": 524,
592
+ "CCCN1C": 525,
593
+ "Oc1cccc": 526,
594
+ "1CS": 527,
595
+ "1Cc2ccccc2": 528,
596
+ "c1ccn": 529,
597
+ "NCc1ccccc1": 530,
598
+ "NCCN": 531,
599
+ "c3ccncc3": 532,
600
+ "Nc1nnc": 533,
601
+ "nn2C": 534,
602
+ "CCCS": 535,
603
+ "CC1CC": 536,
604
+ "NC1CC1": 537,
605
+ "c2nc3c": 538,
606
+ "cccc1Cl": 539,
607
+ "c1sc": 540,
608
+ "c1ccsc1": 541,
609
+ "N1CCCC": 542,
610
+ "CCCC4": 543,
611
+ "1c1cccc": 544,
612
+ "CCl": 545,
613
+ "ccn1": 546,
614
+ "OC1": 547,
615
+ "cc2C1": 548,
616
+ "Cc1cc2": 549,
617
+ "nc2n1": 550,
618
+ "c2cc3c": 551,
619
+ "1OCC": 552,
620
+ "on2": 553,
621
+ "Nc2ccc3c": 554,
622
+ "oc2": 555,
623
+ "1CCCCN1C": 556,
624
+ "ccc2F": 557,
625
+ "nc2c": 558,
626
+ "oc2c1": 559,
627
+ "NC2CC2": 560,
628
+ "nnc": 561,
629
+ "CCc1n": 562,
630
+ "NC3": 563,
631
+ "cccc1F": 564,
632
+ "CSc1n": 565,
633
+ "1CCOC1": 566,
634
+ "2NC": 567,
635
+ "nc21": 568,
636
+ "4CC": 569,
637
+ "c2ccsc2": 570,
638
+ "CC1CCN": 571,
639
+ "Nc1ccccc1C": 572,
640
+ "c2ncccn2": 573,
641
+ "c2nccs2": 574,
642
+ "Cc1ccsc1": 575,
643
+ "c3ccccc3C2": 576,
644
+ "c2n1": 577,
645
+ "2CS": 578,
646
+ "Nc3ccccc3": 579,
647
+ "1N": 580,
648
+ "Cn2cc": 581,
649
+ "CCNS": 582,
650
+ "Cn2": 583,
651
+ "CCCO2": 584,
652
+ "Cc1ccco1": 585,
653
+ "cccc1": 586,
654
+ "3CC3": 587,
655
+ "4C": 588,
656
+ "NCCNC": 589,
657
+ "Cc1ccccc1C": 590,
658
+ "c2cncc": 591,
659
+ "3CCCCC3": 592,
660
+ "Nc3cccc": 593,
661
+ "NCc1cccc": 594,
662
+ "OCO4": 595,
663
+ "Cc2nc": 596,
664
+ "nc2cc": 597,
665
+ "Cc1cnn": 598,
666
+ "CCN1CC": 599,
667
+ "CCc1c": 600,
668
+ "c1cc2ccccc2": 601,
669
+ "c32": 602,
670
+ "c1o": 603,
671
+ "c2ccccc2n1": 604,
672
+ "nc23": 605,
673
+ "CCOCC1": 606,
674
+ "Cc1cccc2": 607,
675
+ "N3CCCCC3": 608,
676
+ "CSc2nnc": 609,
677
+ "2c2ccc": 610,
678
+ "Cc3c": 611,
679
+ "1CCOC2": 612,
680
+ "CCCn1c": 613,
681
+ ")=[": 614,
682
+ "N2CCCC": 615,
683
+ "ccc2Cl": 616,
684
+ "Nc2ccccc2C": 617,
685
+ "c4ccccc43": 618,
686
+ "OCCC": 619,
687
+ "c3nc4ccccc4": 620,
688
+ "Oc1ccccc1": 621,
689
+ "c2nc3ccccc3s2": 622,
690
+ "2N": 623,
691
+ "cc32": 624,
692
+ "ccccc23": 625,
693
+ "c2oc": 626,
694
+ "Cc1cccnc1": 627,
695
+ "c1nc2ccccc2s1": 628,
696
+ "NC1CCCCC1": 629,
697
+ "c21": 630,
698
+ "ccc1Br": 631,
699
+ "Sc1nnc": 632,
700
+ "Oc2ccccc2": 633,
701
+ "1OC": 634,
702
+ "c3ccccc3Cl": 635,
703
+ "c3s": 636,
704
+ "SC1": 637,
705
+ "NCc2cc": 638,
706
+ "c2o": 639,
707
+ "CO2": 640,
708
+ "COCCN": 641,
709
+ "Nc3cc": 642,
710
+ "ccccc5": 643,
711
+ "COc1c": 644,
712
+ "C1N": 645,
713
+ "COc1ccccc1C": 646,
714
+ "COc1ccccc1NC": 647,
715
+ "Cc1o": 648,
716
+ "CSc1nc": 649,
717
+ "nc2s": 650,
718
+ "n2cncn2": 651,
719
+ "c2ccccc2O1": 652,
720
+ "n2cnn": 653,
721
+ "N2CCO": 654,
722
+ "ccc32": 655,
723
+ "c34": 656,
724
+ "Cc1ccccc1NC": 657,
725
+ "c3nn": 658,
726
+ "c2c1C": 659,
727
+ "no3": 660,
728
+ "1CCCCC": 661,
729
+ "ccc2c1": 662,
730
+ "3CCN": 663,
731
+ "n1nc": 664,
732
+ "oc1C": 665,
733
+ "Cc1ccccn1": 666,
734
+ "CCc2ccccc2": 667,
735
+ "n3nc": 668,
736
+ "Fc1ccc": 669,
737
+ "O3": 670,
738
+ "c1ccc2ccccc2c1": 671,
739
+ "n2CC": 672,
740
+ "CCCCNC": 673,
741
+ "c2Cl": 674,
742
+ "CCCc1cc": 675,
743
+ "c1CC": 676,
744
+ "Cc1nc2ccccc2": 677,
745
+ "Cc2ccco2": 678,
746
+ "CN1CCC": 679,
747
+ "CN2CCC": 680,
748
+ "2CCOC2": 681,
749
+ "c1cccc2ccccc12": 682,
750
+ "FC": 683,
751
+ "n2ccnc2": 684,
752
+ "CCOCC": 685,
753
+ "CCC4": 686,
754
+ "2C3": 687,
755
+ "c1ccnc": 688,
756
+ "2c2ccccc2": 689,
757
+ "(\\[": 690,
758
+ "Cc3cccc": 691,
759
+ "cc3C": 692,
760
+ "Cc3cc": 693,
761
+ "n2n1": 694,
762
+ "cc1N": 695,
763
+ "cccc2Cl": 696,
764
+ "cn": 697,
765
+ "NCc2ccccc2": 698,
766
+ "1CCc2c": 699,
767
+ "n1cccn1": 700,
768
+ "2CCOCC2": 701,
769
+ "NCC2": 702,
770
+ "cn3": 703,
771
+ "CCCCN": 704,
772
+ "NC1CC": 705,
773
+ "COCCNC": 706,
774
+ "Cc4ccccc4": 707,
775
+ "CCCOc1ccc": 708,
776
+ "COc1cccc2": 709,
777
+ "NC1CCCC1": 710,
778
+ "2CC3CC": 711,
779
+ "cc23": 712,
780
+ "C4CC4": 713,
781
+ "CN2CCOCC2": 714,
782
+ "CCc1noc": 715,
783
+ "c1nc2c": 716,
784
+ "c1CCC": 717,
785
+ "c3cnn": 718,
786
+ "cnn1C": 719,
787
+ "sc2nc": 720,
788
+ "Cc1cc2c": 721,
789
+ "ccc4": 722,
790
+ "c2C1": 723,
791
+ "nc2ccccc12": 724,
792
+ "1COc2ccccc2O1": 725,
793
+ "CCCO1": 726,
794
+ "n3cccn3": 727,
795
+ "Cc1cn": 728,
796
+ "cccc2F": 729,
797
+ "NCc2cccc": 730,
798
+ "Cc1ccc2nc": 731,
799
+ "N2CCCCCC2": 732,
800
+ "CCCn1cc": 733,
801
+ "c1ccccc1OC": 734,
802
+ "n23": 735,
803
+ "SCC1": 736,
804
+ "cc1CNC": 737,
805
+ "Nc1cccc2": 738,
806
+ "CN1CCO": 739,
807
+ "Cc2cccs2": 740,
808
+ "n2cccc2": 741,
809
+ "NCc1ccco1": 742,
810
+ "Nc2nnc": 743,
811
+ "c1ncccc1C": 744,
812
+ "CCCCC4": 745,
813
+ "s4": 746,
814
+ "CCN1CCN": 747,
815
+ "c3ncccn3": 748,
816
+ "cnn1": 749,
817
+ "1C2": 750,
818
+ "c2F": 751,
819
+ "CCCCC3": 752,
820
+ "1CCOCC1": 753,
821
+ "Nc1cccnc1": 754,
822
+ "N1CCC2": 755,
823
+ "n2nn": 756,
824
+ "Cc2csc": 757,
825
+ "c5ccccc5": 758,
826
+ "Cc1ccnc": 759,
827
+ "cc2s1": 760,
828
+ "C1NC": 761,
829
+ "COc1cc2c": 762,
830
+ "c2ccccn12": 763,
831
+ "3CCOCC3": 764,
832
+ "n1nn": 765,
833
+ "C1CCOCC1": 766,
834
+ "ncn3": 767,
835
+ "c3cc4": 768,
836
+ "n2c1": 769,
837
+ "ccc23": 770,
838
+ "CCc1nnc": 771,
839
+ "c2N": 772,
840
+ "CCN1": 773,
841
+ "C1CCC1": 774,
842
+ "CCOCC4": 775,
843
+ "c1ccccc1Br": 776,
844
+ "nn3C": 777,
845
+ "nn12": 778,
846
+ "nc3ccccc32": 779,
847
+ "CC1CCC": 780,
848
+ "Nc1cnn": 781,
849
+ "nc3c": 782,
850
+ "n1C1CC1": 783,
851
+ "c4ccccc34": 784,
852
+ "1Cc1ccccc1": 785,
853
+ "NCCO": 786,
854
+ "CNc1ccc": 787,
855
+ "N1CCc2cc": 788,
856
+ "nc3c2": 789,
857
+ "cccc1NC": 790,
858
+ "1CCCCCC1": 791,
859
+ "c2sccc2": 792,
860
+ "CC1CC1": 793,
861
+ "OCCCO2": 794,
862
+ "C1CN": 795,
863
+ "CCOCC2": 796,
864
+ "c2nnnn2": 797,
865
+ "CNc2ccc": 798,
866
+ "c2ncn": 799,
867
+ "C3CCCCC3": 800,
868
+ "c2cccnc21": 801,
869
+ "CN1": 802,
870
+ "N1CCc2ccccc21": 803,
871
+ "Cc1oc": 804,
872
+ "Oc2cc": 805,
873
+ "1CCCCO1": 806,
874
+ "Cn1ccc": 807,
875
+ "Cc1ccccc1F": 808,
876
+ "c2cc3ccccc3": 809,
877
+ "N1c1ccc": 810,
878
+ "o4": 811,
879
+ "Oc2cccc": 812,
880
+ "cc1OCC": 813,
881
+ "C3CCCC3": 814,
882
+ "c1ccc2": 815,
883
+ "ccc1N": 816,
884
+ "NC1CCN": 817,
885
+ "c2nc3ccc": 818,
886
+ "NCCc1ccc": 819,
887
+ "NC2CCCCC2": 820,
888
+ "+])(": 821,
889
+ "c1ncnc": 822,
890
+ "Cn2nc": 823,
891
+ "c2ccccc2OC": 824,
892
+ "Cc1ccn": 825,
893
+ "N1CCCN": 826,
894
+ "Cc2ccccn2": 827,
895
+ "12CC": 828,
896
+ "CCO3": 829,
897
+ "SCC2": 830,
898
+ "cccc1C": 831,
899
+ "1CCCc2ccccc21": 832,
900
+ "Cc2cccnc2": 833,
901
+ "Nc3nc": 834,
902
+ "c1CNC": 835,
903
+ "c2nccc": 836,
904
+ "N1CCOC": 837,
905
+ "nc2c1c": 838,
906
+ "SC2": 839,
907
+ "c3ccccc3n2": 840,
908
+ "OCCO4": 841,
909
+ "cc3F": 842,
910
+ "Cn1ncc2": 843,
911
+ "Cc1sc": 844,
912
+ "OCc2ccccc2": 845,
913
+ "Nc1nc2c": 846,
914
+ "23": 847,
915
+ "OCCN": 848,
916
+ "c2ccccc2N": 849,
917
+ "N1CCCCCC1": 850,
918
+ "c4nc": 851,
919
+ "cc3C2": 852,
920
+ "c1ccccc1O": 853,
921
+ "oc2cc": 854,
922
+ "2CO1": 855,
923
+ "Sc2ccc": 856,
924
+ "c1ccccc12": 857,
925
+ "c2nc3cc": 858,
926
+ "nc2ccccc2c1": 859,
927
+ "Nc1ncc": 860,
928
+ "2CCCCCC2": 861,
929
+ "ccc1OCC": 862,
930
+ "ccc2OC": 863,
931
+ "ccc2o1": 864,
932
+ "NC2CC": 865,
933
+ "c2ccnc": 866,
934
+ "CO1": 867,
935
+ "1CNC": 868,
936
+ "Nc1ccccc1F": 869,
937
+ "CN2CCO": 870,
938
+ "c2sc3c": 871,
939
+ "NCc3ccc": 872,
940
+ "NC3CC3": 873,
941
+ "Clc1ccc": 874,
942
+ "nc2s1": 875,
943
+ "c2cnccn2": 876,
944
+ "CCc1ccccc1NC": 877,
945
+ "NCCS": 878,
946
+ "NCc1cccnc1": 879,
947
+ "NCCCC": 880,
948
+ "cccnc12": 881,
949
+ "n3ccnc3": 882,
950
+ "oc12": 883,
951
+ "c2ccccc2O": 884,
952
+ "n2cnnn2": 885,
953
+ "2S": 886,
954
+ "c2n1CC": 887,
955
+ "C2CCOCC2": 888,
956
+ "noc2C": 889,
957
+ "cc3Cl": 890,
958
+ "CN1CCOCC1": 891,
959
+ "Cc1ccccc1Cl": 892,
960
+ "c1ccoc1": 893,
961
+ "c4ccco4": 894,
962
+ "cccc21": 895,
963
+ "c2ccoc2": 896,
964
+ "Cn1ccnc1": 897,
965
+ "c1cc2ccccc2o1": 898,
966
+ "Oc1cc": 899,
967
+ "Cc1ccncc1": 900,
968
+ "c3cncc": 901,
969
+ "c2cc1C": 902,
970
+ "c2ncnc": 903,
971
+ "CNc1cc": 904,
972
+ "c2ncnc3": 905,
973
+ "Cn1nn": 906,
974
+ "12C": 907,
975
+ "NC1CCC": 908,
976
+ "c2ccn": 909,
977
+ "c2ccc3ccccc3c2": 910,
978
+ "CCCOC": 911,
979
+ "Cc2ccccc2F": 912,
980
+ "CSc1cccc": 913,
981
+ "Cc1nc2c": 914,
982
+ "Cc1cncc": 915,
983
+ "Cc2ccccc2Cl": 916,
984
+ "CCc3ccccc3": 917,
985
+ "COc2ccccc2": 918,
986
+ "n3n2": 919,
987
+ "sc2n1": 920,
988
+ "CC2CC2": 921,
989
+ "COC2": 922,
990
+ "Nc1nccs1": 923,
991
+ "Sc1n": 924,
992
+ "oc2ccccc12": 925,
993
+ "c3ccsc3": 926,
994
+ "OCc2ccc": 927,
995
+ "CCOc1c": 928,
996
+ "ccc2n1": 929,
997
+ "5c": 930,
998
+ "NCc1nc": 931,
999
+ "c3n2": 932,
1000
+ "c2cccc3ccccc23": 933,
1001
+ "3c": 934,
1002
+ "Nc4ccc": 935,
1003
+ "CCc2ccc": 936,
1004
+ "COCCN1C": 937,
1005
+ "c2cs": 938,
1006
+ "cc3c": 939,
1007
+ "n3cncn3": 940,
1008
+ "OCc1ccccc1": 941,
1009
+ "C2CCC": 942,
1010
+ "1c1cc": 943,
1011
+ "Sc1ccc": 944,
1012
+ "nc2nc": 945,
1013
+ "NCCc1c": 946,
1014
+ "Cc1nc2cc": 947,
1015
+ "2c2cccc": 948,
1016
+ "3CS": 949,
1017
+ "nnc3": 950,
1018
+ "c2O": 951,
1019
+ "3CCCN": 952,
1020
+ "N4CCOCC4": 953,
1021
+ "2CCOC3": 954,
1022
+ "nc32": 955,
1023
+ "Cc2nnc": 956,
1024
+ "c2c3c": 957,
1025
+ "NCc1ccc2c": 958,
1026
+ "COCc1cc": 959,
1027
+ "cc2c": 960,
1028
+ "(=[": 961,
1029
+ "NC2CCCC2": 962,
1030
+ "1CCCCN": 963,
1031
+ "cc3s2": 964,
1032
+ "oc3": 965,
1033
+ "NCc1c": 966,
1034
+ "NCc2ccco2": 967,
1035
+ "n1n": 968,
1036
+ "c3cccc4": 969,
1037
+ "Cc1cs": 970,
1038
+ "c1oc": 971,
1039
+ "c2nnn": 972,
1040
+ "c1S": 973,
1041
+ "COc2cccc": 974,
1042
+ "2CCCCC": 975,
1043
+ "c4cccs4": 976,
1044
+ "c1cnccn1": 977,
1045
+ "Cc2ccc3c": 978,
1046
+ "nc2sc": 979,
1047
+ "Cn1n": 980,
1048
+ "ccc2O": 981,
1049
+ "c3sc": 982,
1050
+ "CCOc1ccccc1NC": 983,
1051
+ "c1nnc2ccccn12": 984,
1052
+ "c1nc2ccccc2c": 985,
1053
+ "CCSC": 986,
1054
+ "Nc2cnn": 987,
1055
+ "n1cccc1": 988,
1056
+ "c1nc2cc": 989,
1057
+ "c3ccccc3O2": 990,
1058
+ "c1Br": 991,
1059
+ "Nc1ccccc1Cl": 992,
1060
+ "nc2ccc": 993,
1061
+ "2CCC2": 994,
1062
+ "CS2": 995,
1063
+ "oc2C": 996,
1064
+ "n1N": 997,
1065
+ "N4CCCC4": 998,
1066
+ "c3nccs3": 999,
1067
+ "N1CCc2c": 1000,
1068
+ "N2CCCN": 1001,
1069
+ "cn12": 1002,
1070
+ "c2ncccc2C": 1003,
1071
+ "1c1cccs1": 1004,
1072
+ "cnc12": 1005,
1073
+ "OC2CCCC2": 1006,
1074
+ "nnc2": 1007,
1075
+ "3CCS": 1008,
1076
+ "CCCO4": 1009,
1077
+ "C2CCC2": 1010,
1078
+ "C3C": 1011,
1079
+ "c4ccccc4c3": 1012,
1080
+ "c1cs": 1013,
1081
+ "c1C1CC1": 1014,
1082
+ "n1cncn1": 1015,
1083
+ "CN3C": 1016,
1084
+ "c3noc": 1017,
1085
+ "NCCN1C": 1018,
1086
+ "CCc1ncc": 1019,
1087
+ "c1nc2ccc": 1020,
1088
+ "CCOC2": 1021,
1089
+ "N1N": 1022,
1090
+ "nc3C": 1023
1091
+ },
1092
+ "merges": [
1093
+ "c c",
1094
+ "C C",
1095
+ "c 1",
1096
+ "( =",
1097
+ "c 2",
1098
+ "c1 cc",
1099
+ "] (",
1100
+ "@ @",
1101
+ "N C",
1102
+ "c2 cc",
1103
+ "c 3",
1104
+ "CC C",
1105
+ "c1cc c",
1106
+ ") [",
1107
+ "cc 1",
1108
+ "N H",
1109
+ "+ ]",
1110
+ "c1cc cc",
1111
+ "C O",
1112
+ "1 CC",
1113
+ "c2cc cc",
1114
+ "n 1",
1115
+ "C l",
1116
+ "n c",
1117
+ "C 1",
1118
+ "c3 cc",
1119
+ "2 CC",
1120
+ "O C",
1121
+ "CC 1",
1122
+ "c2cc c",
1123
+ "c2cccc c2",
1124
+ "c1cccc c1",
1125
+ ") (",
1126
+ "( -",
1127
+ "C N",
1128
+ "( [",
1129
+ "cc 2",
1130
+ "n 2",
1131
+ "- ]",
1132
+ ") (=",
1133
+ "1 C",
1134
+ "n H",
1135
+ "C 2",
1136
+ "CC 2",
1137
+ "c1 n",
1138
+ "1 CCC",
1139
+ "c3cc cc",
1140
+ "-] )",
1141
+ "c1 c",
1142
+ "c2 c",
1143
+ "C c1ccc",
1144
+ "+ ](",
1145
+ "NH 2",
1146
+ "CC O",
1147
+ ") =",
1148
+ "c3cccc c3",
1149
+ "2 C",
1150
+ "CC N",
1151
+ "c 4",
1152
+ "C c1cc",
1153
+ "N 1CC",
1154
+ "n n",
1155
+ "CO c1ccc",
1156
+ "2 CCC",
1157
+ "s 1",
1158
+ "B r",
1159
+ "C NC",
1160
+ "C S",
1161
+ "c3cc c",
1162
+ "N 2CC",
1163
+ "c2 n",
1164
+ "cc c1",
1165
+ "+] (=",
1166
+ "c1 nc",
1167
+ "CO C",
1168
+ "o 1",
1169
+ "cc 3",
1170
+ "3 CC",
1171
+ "c1 C",
1172
+ "n c2",
1173
+ "cc cc",
1174
+ "N CC",
1175
+ "C 1CC",
1176
+ "n c1",
1177
+ "n 3",
1178
+ "c3 c",
1179
+ "+] [",
1180
+ "N c1ccc",
1181
+ "cc c",
1182
+ "C c1n",
1183
+ "CC 3",
1184
+ "]( [",
1185
+ "NH 3",
1186
+ "s 2",
1187
+ "C c1c",
1188
+ "c2 nc",
1189
+ "C n1",
1190
+ "cc c2",
1191
+ "C c1cccc",
1192
+ "s c",
1193
+ "C 2CC",
1194
+ "N 1CCC",
1195
+ "C 3",
1196
+ "O CC",
1197
+ "CCC 1",
1198
+ "1CC N",
1199
+ "o 2",
1200
+ "CO c1cc",
1201
+ "( /",
1202
+ "C c1ccccc1",
1203
+ "CCC 2",
1204
+ "@ ]",
1205
+ "CC OC",
1206
+ "@@ ]",
1207
+ "o c",
1208
+ "CC NC",
1209
+ "O 1",
1210
+ "N 1C",
1211
+ "cc1 C",
1212
+ "CC n1",
1213
+ "N c1cc",
1214
+ "+] )",
1215
+ "N1CC N",
1216
+ "N 2CCC",
1217
+ "c2ccccc2 1",
1218
+ ") /",
1219
+ "c4 cccc",
1220
+ "N 2C",
1221
+ "N c2ccc",
1222
+ "N 3",
1223
+ "N c1cccc",
1224
+ "CC CC",
1225
+ "S C",
1226
+ "CO c1cccc",
1227
+ "C c1nc",
1228
+ "n cc",
1229
+ "n2 c",
1230
+ "1 CN",
1231
+ "c2 c1",
1232
+ "N 1",
1233
+ "S CC",
1234
+ "C2CC 2",
1235
+ "cc1 F",
1236
+ "n c3",
1237
+ "CO c1ccccc1",
1238
+ "c4cccc c4",
1239
+ "C c2ccc",
1240
+ "c n1",
1241
+ "c1 2",
1242
+ "cc1 Cl",
1243
+ "C c2ccccc2",
1244
+ "CC S",
1245
+ "c1n nc",
1246
+ "3 C",
1247
+ "CCC O",
1248
+ "1CC CC",
1249
+ "C1CC 1",
1250
+ "c1cc c2c",
1251
+ "n n1",
1252
+ "1CCC N",
1253
+ "N2CC N",
1254
+ "c1n cc",
1255
+ "CCC 3",
1256
+ "c2 C",
1257
+ "N NC",
1258
+ "c2n cc",
1259
+ "N c1ccccc1",
1260
+ "CCO c1ccc",
1261
+ "O CO",
1262
+ "CCN 1C",
1263
+ "@ ](",
1264
+ "cc1 OC",
1265
+ "n o1",
1266
+ "O CC2",
1267
+ "O CC1",
1268
+ "N S",
1269
+ "N 2",
1270
+ "N c2cc",
1271
+ "n n2",
1272
+ "O 2",
1273
+ "c3 nc",
1274
+ "Cn1 c",
1275
+ "CN 1C",
1276
+ "@@ ](",
1277
+ "cc1 NC",
1278
+ "O CCO",
1279
+ "= [",
1280
+ "N 3CC",
1281
+ "c2n nc",
1282
+ "2CC CC",
1283
+ "CC c1ccc",
1284
+ "c s1",
1285
+ "CN 2CC",
1286
+ "NC c1ccc",
1287
+ "n2 cc",
1288
+ "c4 ccc",
1289
+ "s 3",
1290
+ "C 3CC",
1291
+ "c3ccccc3 2",
1292
+ "n cc2",
1293
+ "N CCC",
1294
+ "c2 3",
1295
+ "Cn1 cc",
1296
+ "c1n n",
1297
+ "c2ccc s2",
1298
+ "CCn1 c",
1299
+ "N c2cccc",
1300
+ "c1ccc s1",
1301
+ "cc c3",
1302
+ "N c2ccccc2",
1303
+ "o 3",
1304
+ "Cc1n n",
1305
+ "1CC O",
1306
+ "c2cccc c12",
1307
+ "C c1",
1308
+ "c2cc c3c",
1309
+ "s c1",
1310
+ "c3 n",
1311
+ "c1cc 2",
1312
+ "n1 C",
1313
+ "CC CC2",
1314
+ "n cc1",
1315
+ "1CC 1",
1316
+ "1CCC O1",
1317
+ "n1 c",
1318
+ "1 NC",
1319
+ "c2ccc nc2",
1320
+ "+]( [",
1321
+ "C c2c",
1322
+ "c2ccc o2",
1323
+ "N2CC OCC2",
1324
+ "1CC CC1",
1325
+ "n2 C",
1326
+ "N N",
1327
+ "c1ccc o1",
1328
+ "3 CCC",
1329
+ "CCO 1",
1330
+ "c2 nn",
1331
+ "c4 c",
1332
+ "cc cc2",
1333
+ "C c3ccccc3",
1334
+ "ccc2 1",
1335
+ "C1CC N",
1336
+ "N1CC OCC1",
1337
+ "N c1c",
1338
+ "cc 4",
1339
+ "CCC NC",
1340
+ "N2CC CC2",
1341
+ "C c2cc",
1342
+ "+] =",
1343
+ "c1n c2ccccc2",
1344
+ "2CCC O2",
1345
+ "1CC S",
1346
+ "1 CO",
1347
+ "2CC N",
1348
+ "C3CC 3",
1349
+ "1CC CCC1",
1350
+ "cc2 C",
1351
+ "-] )[",
1352
+ "C c2cccc",
1353
+ "C 4",
1354
+ "NC 1",
1355
+ "Cc1n oc",
1356
+ "OC 2",
1357
+ "O c1ccc",
1358
+ "c2ccccc2 C",
1359
+ "c2ccccc2 F",
1360
+ "CC CC1",
1361
+ "Cc1c sc",
1362
+ "c1ccccc1 F",
1363
+ "2CC CC2",
1364
+ "CCC N",
1365
+ "c2ccccc2 c1",
1366
+ "1 O",
1367
+ "NC 2",
1368
+ "c1ccccc1 C",
1369
+ "ccc1 C",
1370
+ "1 c1ccc",
1371
+ "c1cccc n1",
1372
+ "ccc1 2",
1373
+ "ccc1 F",
1374
+ "c n2",
1375
+ "n 4",
1376
+ "c2n c3ccccc3",
1377
+ "ccc n2",
1378
+ "c1 OC",
1379
+ "c1c n",
1380
+ "nc1 2",
1381
+ "CCO CC3",
1382
+ "c1cccc 2",
1383
+ "c2cc 3",
1384
+ "n o2",
1385
+ "c1ccccc1 Cl",
1386
+ "c1cc ncc1",
1387
+ "CC 4",
1388
+ "2CCC N",
1389
+ "n c1C",
1390
+ "OCO 2",
1391
+ "s c2",
1392
+ "c1ccccc1 NC",
1393
+ "n1 cc",
1394
+ "OCCO 2",
1395
+ "CN 2C",
1396
+ "c1ccc nc1",
1397
+ "n2 nc",
1398
+ "C c3ccc",
1399
+ "2CC CCC2",
1400
+ "c2ccccc2 Cl",
1401
+ "c 5",
1402
+ "S 1",
1403
+ "c2cccc n2",
1404
+ "c2c nn",
1405
+ "C1 C",
1406
+ "nn c1",
1407
+ "CC CC3",
1408
+ "c1 NC",
1409
+ "s c1C",
1410
+ "CCn1 cc",
1411
+ "nc 4",
1412
+ "N c3ccc",
1413
+ "2CC 2",
1414
+ "cc1 2",
1415
+ "c2 s",
1416
+ "c2cc ncc2",
1417
+ "Nc1cc c2c",
1418
+ "N c1nc",
1419
+ "( \\",
1420
+ "cc2 Cl",
1421
+ "CO CC",
1422
+ "cc2 1",
1423
+ "cc2 F",
1424
+ "c3cccc c23",
1425
+ "nc2 c1",
1426
+ "o n1",
1427
+ "c2c n",
1428
+ "c1c sc",
1429
+ "c1c nc",
1430
+ "2 C1",
1431
+ "N1CC CC1",
1432
+ "c s2",
1433
+ "ccc1 Cl",
1434
+ "ccc1 NC",
1435
+ "c1n oc",
1436
+ "N3 CCC",
1437
+ "CN 1CC",
1438
+ "N 4",
1439
+ "ccc1 OC",
1440
+ "Cc1n cc",
1441
+ "NC c2ccc",
1442
+ ")( [",
1443
+ "c3ccc s3",
1444
+ "C1CC CC1",
1445
+ "c1 F",
1446
+ "2 1",
1447
+ "s c2c1",
1448
+ "OCO 3",
1449
+ "CC c1nn",
1450
+ "n3 c",
1451
+ "3 2",
1452
+ "C1 CCC",
1453
+ "C1CC CCC1",
1454
+ "CN S",
1455
+ "n cc3",
1456
+ "CN 1CCN",
1457
+ "2 c",
1458
+ "CCCO 3",
1459
+ "nn1 C",
1460
+ "@@] (=",
1461
+ "c2ccccc2 C1",
1462
+ "2 CO",
1463
+ "CC CCC",
1464
+ "c3cc c4c",
1465
+ "c1c nn",
1466
+ "Cc1cc c2c",
1467
+ "CCO 2",
1468
+ "c1 O",
1469
+ "c3 c2",
1470
+ "N3CC CC3",
1471
+ "CCO c1cc",
1472
+ "CS C",
1473
+ "CC c1cc",
1474
+ "cc cc3",
1475
+ "c2c sc",
1476
+ "c2n oc",
1477
+ "C n2c",
1478
+ "cc1 S",
1479
+ "c3ccccc3 C",
1480
+ "cccc c4",
1481
+ "c3ccc nc3",
1482
+ "COc1cc c2c",
1483
+ "Cc1n nc",
1484
+ "c1 Cl",
1485
+ "N2CC CCC2",
1486
+ "cccc c2",
1487
+ "O c2ccc",
1488
+ "2 CN",
1489
+ "c1 s",
1490
+ "-]) =",
1491
+ "C2CC N",
1492
+ "c3 ncc",
1493
+ "c3 C",
1494
+ "c3ccc o3",
1495
+ "@] (=",
1496
+ "N c2nc",
1497
+ "nc n2",
1498
+ "N3 CCOCC3",
1499
+ "c3nc 4",
1500
+ "1 S",
1501
+ "CO c2ccc",
1502
+ "n c2ccccc21",
1503
+ "n2 cccn2",
1504
+ "ccc2 C",
1505
+ "c1cc2 c",
1506
+ "n o",
1507
+ "3CC CC",
1508
+ "cc2 c1",
1509
+ "n1 2",
1510
+ "1 c1ccccc1",
1511
+ "ccc1 O",
1512
+ "N c1n",
1513
+ "cc1 Br",
1514
+ "C2 C",
1515
+ "/ [",
1516
+ "N3 C",
1517
+ "c3cccc n3",
1518
+ "c1 N",
1519
+ "CS c1ccc",
1520
+ "c1c ncc",
1521
+ "OCCO 3",
1522
+ "cc ccc12",
1523
+ "CC CCC2",
1524
+ "2CC S",
1525
+ "c3ccccc3 c2",
1526
+ "C2CC CC2",
1527
+ "3 CCCO3",
1528
+ "c2 sc",
1529
+ "CC CCC1",
1530
+ "nn n1",
1531
+ "cccc c3",
1532
+ "C2CC CCC2",
1533
+ "ccc n1",
1534
+ "N3 CCN",
1535
+ "3 C2",
1536
+ "c3ccccc3 F",
1537
+ "CN2CC N",
1538
+ "2CC O",
1539
+ "ccc n3",
1540
+ "CS CC",
1541
+ "c2c nc",
1542
+ "CCn1 nc",
1543
+ "OC 3",
1544
+ "2 O",
1545
+ "N CC1",
1546
+ "Cc1c nc",
1547
+ "c3n nc",
1548
+ "N1CC CCC1",
1549
+ "CCN 2C",
1550
+ "CC c1nc",
1551
+ "N1CC O",
1552
+ "n 1CC",
1553
+ "nn 3",
1554
+ "Cn1 nc",
1555
+ "S 2",
1556
+ "n3 cc",
1557
+ "cc1 O",
1558
+ "c1ncc s1",
1559
+ "c2cccc 3",
1560
+ "CCO c1ccccc1",
1561
+ "o c1",
1562
+ "CC c1ccccc1",
1563
+ "nc n1",
1564
+ "c4 cc",
1565
+ "CS c1nnc",
1566
+ "CC c1cccc",
1567
+ "Cc1ccc s1",
1568
+ "1 2",
1569
+ "NC c1cc",
1570
+ "nc2 C",
1571
+ "1CCC N1C",
1572
+ "3CC CC3",
1573
+ "n3 C",
1574
+ "CCO c1cccc",
1575
+ "N c2c",
1576
+ "2CCC N2C",
1577
+ "s c3",
1578
+ "+] )[",
1579
+ "CCC N1C",
1580
+ "O c1cccc",
1581
+ "1C S",
1582
+ "1C c2ccccc2",
1583
+ "c1cc n",
1584
+ "NC c1ccccc1",
1585
+ "N CCN",
1586
+ "c3cc ncc3",
1587
+ "N c1nnc",
1588
+ "nn2 C",
1589
+ "CCC S",
1590
+ "CC 1CC",
1591
+ "NC 1CC1",
1592
+ "c2n c3c",
1593
+ "cc cc1Cl",
1594
+ "c1 sc",
1595
+ "c1cc sc1",
1596
+ "N1CC CC",
1597
+ "CCCC 4",
1598
+ "1 c1cccc",
1599
+ "CC l",
1600
+ "cc n1",
1601
+ "O C1",
1602
+ "cc2 C1",
1603
+ "Cc1cc 2",
1604
+ "nc2 n1",
1605
+ "c2cc3 c",
1606
+ "1 OCC",
1607
+ "o n2",
1608
+ "Nc2cc c3c",
1609
+ "o c2",
1610
+ "1CC CCN1C",
1611
+ "ccc2 F",
1612
+ "n c2c",
1613
+ "o c2c1",
1614
+ "NC 2CC2",
1615
+ "n nc",
1616
+ "CC c1n",
1617
+ "NC 3",
1618
+ "cc cc1F",
1619
+ "CS c1n",
1620
+ "1CCO C1",
1621
+ "2 NC",
1622
+ "nc2 1",
1623
+ "4 CC",
1624
+ "c2cc sc2",
1625
+ "CC 1CCN",
1626
+ "Nc1ccccc1 C",
1627
+ "c2n cccn2",
1628
+ "c2ncc s2",
1629
+ "Cc1cc sc1",
1630
+ "c3ccccc3 C2",
1631
+ "c2 n1",
1632
+ "2C S",
1633
+ "N c3ccccc3",
1634
+ "1 N",
1635
+ "C n2cc",
1636
+ "CCN S",
1637
+ "C n2",
1638
+ "CCCO 2",
1639
+ "Cc1ccc o1",
1640
+ "cc cc1",
1641
+ "3CC 3",
1642
+ "4 C",
1643
+ "NCC NC",
1644
+ "Cc1ccccc1 C",
1645
+ "c2c ncc",
1646
+ "3CC CCC3",
1647
+ "N c3cccc",
1648
+ "NC c1cccc",
1649
+ "OCO 4",
1650
+ "C c2nc",
1651
+ "n c2cc",
1652
+ "Cc1c nn",
1653
+ "CCN 1CC",
1654
+ "CC c1c",
1655
+ "c1cc2 ccccc2",
1656
+ "c3 2",
1657
+ "c1 o",
1658
+ "c2ccccc2 n1",
1659
+ "nc2 3",
1660
+ "CCO CC1",
1661
+ "Cc1cccc 2",
1662
+ "N3CC CCC3",
1663
+ "CS c2nnc",
1664
+ "2 c2ccc",
1665
+ "C c3c",
1666
+ "1CC OC2",
1667
+ "CCC n1c",
1668
+ ")= [",
1669
+ "N2CC CC",
1670
+ "ccc2 Cl",
1671
+ "Nc2ccccc2 C",
1672
+ "c4ccccc4 3",
1673
+ "O CCC",
1674
+ "c3nc4 ccccc4",
1675
+ "O c1ccccc1",
1676
+ "c2nc3ccccc3 s2",
1677
+ "2 N",
1678
+ "cc3 2",
1679
+ "cccc c23",
1680
+ "c2 oc",
1681
+ "Cc1ccc nc1",
1682
+ "c1nc2ccccc2 s1",
1683
+ "NC 1CCCCC1",
1684
+ "c2 1",
1685
+ "ccc1 Br",
1686
+ "S c1nnc",
1687
+ "O c2ccccc2",
1688
+ "1 OC",
1689
+ "c3ccccc3 Cl",
1690
+ "c3 s",
1691
+ "S C1",
1692
+ "NC c2cc",
1693
+ "c2 o",
1694
+ "CO 2",
1695
+ "CO CCN",
1696
+ "N c3cc",
1697
+ "cccc c5",
1698
+ "CO c1c",
1699
+ "C1 N",
1700
+ "COc1ccccc1 C",
1701
+ "COc1ccccc1 NC",
1702
+ "Cc1 o",
1703
+ "CS c1nc",
1704
+ "nc2 s",
1705
+ "n2c ncn2",
1706
+ "c2ccccc2 O1",
1707
+ "n2c nn",
1708
+ "N2CC O",
1709
+ "ccc3 2",
1710
+ "c3 4",
1711
+ "Cc1ccccc1 NC",
1712
+ "c3 nn",
1713
+ "c2 c1C",
1714
+ "n o3",
1715
+ "1CC CCC",
1716
+ "ccc2 c1",
1717
+ "3 CCN",
1718
+ "n1 nc",
1719
+ "o c1C",
1720
+ "Cc1cccc n1",
1721
+ "CC c2ccccc2",
1722
+ "n3 nc",
1723
+ "F c1ccc",
1724
+ "O 3",
1725
+ "c1cc c2ccccc2c1",
1726
+ "n 2CC",
1727
+ "CC CCNC",
1728
+ "c2 Cl",
1729
+ "CCC c1cc",
1730
+ "c1 CC",
1731
+ "Cc1n c2ccccc2",
1732
+ "Cc2ccc o2",
1733
+ "CN 1CCC",
1734
+ "CN 2CCC",
1735
+ "2CC OC2",
1736
+ "c1cccc2 ccccc12",
1737
+ "F C",
1738
+ "n2cc nc2",
1739
+ "CCO CC",
1740
+ "CCC 4",
1741
+ "2C 3",
1742
+ "c1cc nc",
1743
+ "2 c2ccccc2",
1744
+ "(\\ [",
1745
+ "C c3cccc",
1746
+ "cc3 C",
1747
+ "C c3cc",
1748
+ "n2 n1",
1749
+ "cc1 N",
1750
+ "cccc2 Cl",
1751
+ "c n",
1752
+ "NC c2ccccc2",
1753
+ "1CC c2c",
1754
+ "n1 cccn1",
1755
+ "2CC OCC2",
1756
+ "N CC2",
1757
+ "c n3",
1758
+ "CC CCN",
1759
+ "NC 1CC",
1760
+ "CO CCNC",
1761
+ "C c4ccccc4",
1762
+ "CCCO c1ccc",
1763
+ "COc1cccc 2",
1764
+ "NC 1CCCC1",
1765
+ "2CC 3CC",
1766
+ "cc2 3",
1767
+ "C4 CC4",
1768
+ "CN2CC OCC2",
1769
+ "CC c1noc",
1770
+ "c1n c2c",
1771
+ "c1 CCC",
1772
+ "c3c nn",
1773
+ "c nn1C",
1774
+ "s c2nc",
1775
+ "Cc1cc 2c",
1776
+ "cc c4",
1777
+ "c2 C1",
1778
+ "n c2ccccc12",
1779
+ "1CO c2ccccc2O1",
1780
+ "CCC O1",
1781
+ "n3 cccn3",
1782
+ "Cc1c n",
1783
+ "cccc2 F",
1784
+ "NC c2cccc",
1785
+ "Cc1cc c2nc",
1786
+ "N2CC CCCC2",
1787
+ "CCC n1cc",
1788
+ "c1ccccc1 OC",
1789
+ "n2 3",
1790
+ "S CC1",
1791
+ "cc1 CNC",
1792
+ "Nc1cccc 2",
1793
+ "CN 1CCO",
1794
+ "Cc2ccc s2",
1795
+ "n2cc cc2",
1796
+ "NCc1ccc o1",
1797
+ "N c2nnc",
1798
+ "c1ncc cc1C",
1799
+ "CCCCC 4",
1800
+ "s 4",
1801
+ "CCN 1CCN",
1802
+ "c3n cccn3",
1803
+ "c nn1",
1804
+ "1C 2",
1805
+ "c2 F",
1806
+ "CC CCC3",
1807
+ "1CC OCC1",
1808
+ "Nc1ccc nc1",
1809
+ "N1CCC 2",
1810
+ "n2 nn",
1811
+ "Cc2c sc",
1812
+ "c5 ccccc5",
1813
+ "Cc1cc nc",
1814
+ "cc2 s1",
1815
+ "C1 NC",
1816
+ "COc1cc 2c",
1817
+ "c2cccc n12",
1818
+ "3 CCOCC3",
1819
+ "n1 nn",
1820
+ "C1CC OCC1",
1821
+ "nc n3",
1822
+ "c3cc 4",
1823
+ "n2 c1",
1824
+ "ccc2 3",
1825
+ "CC c1nnc",
1826
+ "c2 N",
1827
+ "CCN 1",
1828
+ "C1 CCC1",
1829
+ "CCO CC4",
1830
+ "c1ccccc1 Br",
1831
+ "nn 3C",
1832
+ "nn1 2",
1833
+ "n c3ccccc32",
1834
+ "CC1 CCC",
1835
+ "Nc1c nn",
1836
+ "n c3c",
1837
+ "n1 C1CC1",
1838
+ "c4cccc c34",
1839
+ "1C c1ccccc1",
1840
+ "N CCO",
1841
+ "CN c1ccc",
1842
+ "N1CC c2cc",
1843
+ "nc3 c2",
1844
+ "cc cc1NC",
1845
+ "1CCCC CC1",
1846
+ "c2s ccc2",
1847
+ "CC 1CC1",
1848
+ "O CCCO2",
1849
+ "C1 CN",
1850
+ "CCO CC2",
1851
+ "c2nn nn2",
1852
+ "CN c2ccc",
1853
+ "c2nc n",
1854
+ "C3CC CCC3",
1855
+ "c2cccnc2 1",
1856
+ "CN 1",
1857
+ "N1CC c2ccccc21",
1858
+ "Cc1 oc",
1859
+ "O c2cc",
1860
+ "1CC CCO1",
1861
+ "Cn1 ccc",
1862
+ "Cc1ccccc1 F",
1863
+ "c2cc3 ccccc3",
1864
+ "N1 c1ccc",
1865
+ "o 4",
1866
+ "O c2cccc",
1867
+ "cc1 OCC",
1868
+ "C3CC CC3",
1869
+ "c1cc c2",
1870
+ "ccc1 N",
1871
+ "NC 1CCN",
1872
+ "c2n c3ccc",
1873
+ "NCC c1ccc",
1874
+ "NC 2CCCCC2",
1875
+ "+] )(",
1876
+ "c1nc nc",
1877
+ "C n2nc",
1878
+ "c2ccccc2 OC",
1879
+ "Cc1cc n",
1880
+ "N1CCC N",
1881
+ "Cc2cccc n2",
1882
+ "1 2CC",
1883
+ "CCO 3",
1884
+ "S CC2",
1885
+ "cc cc1C",
1886
+ "1CCC c2ccccc21",
1887
+ "Cc2ccc nc2",
1888
+ "N c3nc",
1889
+ "c1 CNC",
1890
+ "c2n ccc",
1891
+ "N1CC OC",
1892
+ "nc2 c1c",
1893
+ "S C2",
1894
+ "c3ccccc3 n2",
1895
+ "OCCO 4",
1896
+ "cc3 F",
1897
+ "Cn1 ncc2",
1898
+ "Cc1 sc",
1899
+ "OC c2ccccc2",
1900
+ "Nc1n c2c",
1901
+ "2 3",
1902
+ "O CCN",
1903
+ "c2ccccc2 N",
1904
+ "N1CC CCCC1",
1905
+ "c4 nc",
1906
+ "cc3 C2",
1907
+ "c1ccccc1 O",
1908
+ "o c2cc",
1909
+ "2CO 1",
1910
+ "S c2ccc",
1911
+ "c1ccccc1 2",
1912
+ "c2n c3cc",
1913
+ "n c2ccccc2c1",
1914
+ "N c1ncc",
1915
+ "2CCCC CC2",
1916
+ "ccc1 OCC",
1917
+ "ccc2 OC",
1918
+ "ccc2 o1",
1919
+ "NC 2CC",
1920
+ "c2cc nc",
1921
+ "CO 1",
1922
+ "1C NC",
1923
+ "Nc1ccccc1 F",
1924
+ "CN2CC O",
1925
+ "c2s c3c",
1926
+ "NC c3ccc",
1927
+ "NC 3CC3",
1928
+ "Cl c1ccc",
1929
+ "nc2 s1",
1930
+ "c2cncc n2",
1931
+ "CC c1ccccc1NC",
1932
+ "NCC S",
1933
+ "NCc1ccc nc1",
1934
+ "NCC CC",
1935
+ "ccc nc12",
1936
+ "n3cc nc3",
1937
+ "o c12",
1938
+ "c2ccccc2 O",
1939
+ "n2cnn n2",
1940
+ "2 S",
1941
+ "c2n 1CC",
1942
+ "C2CC OCC2",
1943
+ "no c2C",
1944
+ "cc3 Cl",
1945
+ "CN1CC OCC1",
1946
+ "Cc1ccccc1 Cl",
1947
+ "c1cc oc1",
1948
+ "c4ccc o4",
1949
+ "cccc2 1",
1950
+ "c2cc oc2",
1951
+ "Cn1cc nc1",
1952
+ "c1cc2ccccc2 o1",
1953
+ "O c1cc",
1954
+ "Cc1cc ncc1",
1955
+ "c3c ncc",
1956
+ "c2cc 1C",
1957
+ "c2nc nc",
1958
+ "CN c1cc",
1959
+ "c2nc nc3",
1960
+ "Cn1 nn",
1961
+ "1 2C",
1962
+ "NC 1CCC",
1963
+ "c2cc n",
1964
+ "c2cc c3ccccc3c2",
1965
+ "CCC OC",
1966
+ "Cc2ccccc2 F",
1967
+ "CS c1cccc",
1968
+ "Cc1n c2c",
1969
+ "Cc1c ncc",
1970
+ "Cc2ccccc2 Cl",
1971
+ "CC c3ccccc3",
1972
+ "CO c2ccccc2",
1973
+ "n3 n2",
1974
+ "sc2 n1",
1975
+ "CC 2CC2",
1976
+ "CO C2",
1977
+ "N c1nccs1",
1978
+ "S c1n",
1979
+ "o c2ccccc12",
1980
+ "c3cc sc3",
1981
+ "OC c2ccc",
1982
+ "CCO c1c",
1983
+ "ccc2 n1",
1984
+ "5 c",
1985
+ "NC c1nc",
1986
+ "c3 n2",
1987
+ "c2cccc3 ccccc23",
1988
+ "3 c",
1989
+ "N c4ccc",
1990
+ "CC c2ccc",
1991
+ "CO CCN1C",
1992
+ "c2c s",
1993
+ "cc3 c",
1994
+ "n3c ncn3",
1995
+ "OC c1ccccc1",
1996
+ "C2 CCC",
1997
+ "1 c1cc",
1998
+ "S c1ccc",
1999
+ "nc2 nc",
2000
+ "NCC c1c",
2001
+ "Cc1n c2cc",
2002
+ "2 c2cccc",
2003
+ "3 CS",
2004
+ "nn c3",
2005
+ "c2 O",
2006
+ "3CCC N",
2007
+ "N4 CCOCC4",
2008
+ "2CC OC3",
2009
+ "nc3 2",
2010
+ "C c2nnc",
2011
+ "c2 c3c",
2012
+ "NC c1ccc2c",
2013
+ "CO Cc1cc",
2014
+ "cc2 c",
2015
+ "(= [",
2016
+ "NC 2CCCC2",
2017
+ "1CC CCN",
2018
+ "cc3 s2",
2019
+ "o c3",
2020
+ "NC c1c",
2021
+ "NC c2ccco2",
2022
+ "n1 n",
2023
+ "c3cccc 4",
2024
+ "Cc1c s",
2025
+ "c1 oc",
2026
+ "c2nn n",
2027
+ "c1 S",
2028
+ "CO c2cccc",
2029
+ "2CC CCC",
2030
+ "c4ccc s4",
2031
+ "c1cncc n1",
2032
+ "C c2ccc3c",
2033
+ "nc2 sc",
2034
+ "Cn1 n",
2035
+ "ccc2 O",
2036
+ "c3 sc",
2037
+ "CCO c1ccccc1NC",
2038
+ "c1nn c2ccccn12",
2039
+ "c1nc2ccccc2 c",
2040
+ "CC SC",
2041
+ "N c2cnn",
2042
+ "n1cc cc1",
2043
+ "c1n c2cc",
2044
+ "c3ccccc3 O2",
2045
+ "c1 Br",
2046
+ "Nc1ccccc1 Cl",
2047
+ "n c2ccc",
2048
+ "2CCC 2",
2049
+ "CS 2",
2050
+ "o c2C",
2051
+ "n1 N",
2052
+ "N4 CCCC4",
2053
+ "c3ncc s3",
2054
+ "N1CC c2c",
2055
+ "N2CCC N",
2056
+ "cn1 2",
2057
+ "c2ncc cc2C",
2058
+ "1 c1cccs1",
2059
+ "c nc12",
2060
+ "OC 2CCCC2",
2061
+ "nn c2",
2062
+ "3CC S",
2063
+ "CCCO 4",
2064
+ "C2 CCC2",
2065
+ "C3 C",
2066
+ "c4ccccc4 c3",
2067
+ "c1c s",
2068
+ "c1C 1CC1",
2069
+ "n1c ncn1",
2070
+ "CN 3C",
2071
+ "c3n oc",
2072
+ "N CCN1C",
2073
+ "CC c1ncc",
2074
+ "c1n c2ccc",
2075
+ "CCOC 2",
2076
+ "N1 N",
2077
+ "nc3 C"
2078
+ ]
2079
+ }
2080
+ }
tokenizer_config.json ADDED
@@ -0,0 +1,52 @@
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
1
+ {
2
+ "added_tokens_decoder": {
3
+ "0": {
4
+ "content": "[UNK]",
5
+ "lstrip": false,
6
+ "normalized": false,
7
+ "rstrip": false,
8
+ "single_word": false,
9
+ "special": true
10
+ },
11
+ "1": {
12
+ "content": "[CLS]",
13
+ "lstrip": false,
14
+ "normalized": false,
15
+ "rstrip": false,
16
+ "single_word": false,
17
+ "special": true
18
+ },
19
+ "2": {
20
+ "content": "[SEP]",
21
+ "lstrip": false,
22
+ "normalized": false,
23
+ "rstrip": false,
24
+ "single_word": false,
25
+ "special": true
26
+ },
27
+ "3": {
28
+ "content": "[PAD]",
29
+ "lstrip": false,
30
+ "normalized": false,
31
+ "rstrip": false,
32
+ "single_word": false,
33
+ "special": true
34
+ },
35
+ "4": {
36
+ "content": "[MASK]",
37
+ "lstrip": false,
38
+ "normalized": false,
39
+ "rstrip": false,
40
+ "single_word": false,
41
+ "special": true
42
+ }
43
+ },
44
+ "clean_up_tokenization_spaces": true,
45
+ "cls_token": "[CLS]",
46
+ "mask_token": "[MASK]",
47
+ "model_max_length": 1000000000000000019884624838656,
48
+ "pad_token": "[PAD]",
49
+ "sep_token": "[SEP]",
50
+ "tokenizer_class": "PreTrainedTokenizerFast",
51
+ "unk_token": "[UNK]"
52
+ }
trainer_state.json ADDED
The diff for this file is too large to render. See raw diff
 
training_args.bin ADDED
@@ -0,0 +1,3 @@
 
 
 
 
1
+ version https://git-lfs.github.com/spec/v1
2
+ oid sha256:7e8cdc487da01d2b12be24d25ac3889e52479522c193282aebf80bca8333f368
3
+ size 4920