In ORD (ord_predictions) have tasks with and without atom mapping

[kjappelbaum]

"/scratch/micpie/export/ord_predictions/train_1-4.jsonl": "{"text":"User: I need to produce [O:1]1[CH:2]([CH2:6][CH2:7][N:8]2[CH2:9][C@@H:10]([OH:23])[C@H:11]([CH2:14][NH2:15])[CH2:12][CH2:13]2)[O:3][CH2:4][CH2:5]1.\nAssistant: Is there anything else I can do for you?\nUser: Yes, I would like to know the starting materials I need to produce the reaction products [O:1]1[CH:2]([CH2:6][CH2:7][N:8]2[CH2:9][C@@H:10]([OH:23])[C@H:11]([CH2:14][NH2:15])[CH2:12][CH2:13]2)[O:3][CH2:4][CH2:5]1.\nAssistant: I recommend the following starting materials: CO, [H][H], [Pd], and c1ccc(C[NH:15][CH2:14][C@H:11]2[C@H:10]([OH:23])[CH2:9][N:8]([CH2:7][CH2:6][CH:2]3[O:1][CH2:5][CH2:4][O:3]3)[CH2:13][CH2:12]2)cc1."} {"text":"User: I must synthesize [N+:1](=[O:2])([O-:3])[c:4]1[c:5]([CH2:6][S:12][CH2:13][C:14](=[O:15])[O:16][CH3:17])[cH:8][cH:9][cH:10][cH:11]1.\nAssistant: Cool, is there anything else I can do for you?\nUser: Yes, I would like to know the starting materials I need to produce the products [N+:1](=[O:2])([O-:3])[c:4]1[c:5]([CH2:6][S:12][CH2:13][C:14](=[O:15])[O:16][CH3:17])[cH:8][cH:9][cH:10][cH:11]1.\nAssistant: I recommend the following starting materials: [C:18](=[O:19])([O-:20])[O-:21], [CH3:24][C:25](=[O:26])[CH3:27], [K+:22], [K+:23], [N+:1](=[O:2])([O-:3])[c:4]1[c:5]([CH2:6][Cl:7])[cH:8][cH:9][cH:10][cH:11]1, and [SH:12][CH2:13][C:14](=[O:15])[O:16][CH3:17]."}",