Datasets:
HoangHa
/
belka-selfies-train-cls-ft-ids

Dataset card Viewer Files Community
1
SELFIES
stringlengths
139
644
BRD4
int64
0
1
HSA
int64
0
1
sEH
int64
0
1
input_ids
sequencelengths
7
46
token_type_ids
sequencelengths
7
46
attention_mask
sequencelengths
7
46
labels
sequencelengths
3
3
length
int64
7
46
[C][C][=C][C][Branch1][C][C][=N][C][Branch2][Ring2][=C][N][C][=N][C][Branch2][Ring1][C][N][C][C][C][C][C][Branch1][Branch1][C][C][Ring1][Ring1][C][N][Ring1][Branch2][C][=N][C][Branch1][=C][N][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#Branch2][=N][Ring2][Ring2][C]
0
0
0
[ 2, 1349, 1288, 1276, 1514, 1878, 2300, 1633, 1950, 2569, 1463, 1287, 1355, 1597, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
15
[C][C][N][=C][Branch2][Branch1][=N][C][C][N][C][=N][C][Branch2][Ring1][=Branch1][N][C][C][Branch1][#Branch2][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][O][C][C][Ring1][O][=N][C][Branch2][Ring1][=Branch1][N][C][=C][Branch1][C][F][C][=C][Branch1][C][Br][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][S][S][C][=Ring2][Ring2][Branch2][C]
0
0
0
[ 2, 1274, 1315, 1861, 1274, 2084, 1722, 1444, 1785, 1419, 1418, 1301, 2177, 1455, 433, 1337, 1847, 428, 420, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
20
[C][C][O][C][Branch2][Ring2][#C][C][N][C][=N][C][Branch2][Ring1][C][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][N][C][C][Ring1][#Branch1][=N][C][Branch1][=C][N][C][C][C][C][Ring1][Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#Branch2][C][N][Branch1][C][C][C]
0
0
0
[ 2, 1274, 1294, 2550, 2487, 2959, 2569, 1463, 1287, 1355, 1633, 1332, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
13
[O][=C][Branch2][=Branch1][Ring2][C][C@@H1][Branch2][Branch1][Ring2][N][C][=N][C][Branch2][Ring1][Ring1][N][C][C][C][C][N][Branch1][#Branch1][C][C][Branch1][C][F][F][C][C][Ring1][#Branch2][=N][C][Branch2][Ring1][C][N][C][=N][C][N][=C][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][NH1][Ring1][#Branch2][=N][Ring2][Ring1][=N][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][N][Dy]
0
0
1
[ 2, 2668, 2196, 1713, 1459, 1359, 2242, 1907, 1350, 2232, 1829, 2108, 1524, 1494, 1344, 1411, 1286, 1323, 1325, 424, 435, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 1 ]
22
[C][N][Branch1][=Branch2][C][C][=C][C][=C][O][Ring1][Branch1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][C][=N][C][Branch2][Ring1][Ring1][N][C][=N][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][S][Ring1][O][=N][C][Branch2][Ring1][N][N][C@H1][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][=N][Ring2][Ring2][Ring1]
0
0
0
[ 2, 1633, 1326, 1357, 429, 422, 1425, 1522, 1359, 1599, 1687, 1560, 1419, 2155, 1634, 1407, 1357, 1448, 1568, 1490, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
21
[C][O][C][=Branch1][C][=O][C][=C][N][=C][C][=C][Ring1][=Branch1][N][C][=N][C][Branch2][Ring1][C][N][C][=C][C][=C][C][Branch1][#Branch1][N][C][Branch1][C][C][=O][=N][Ring1][#Branch2][=N][C][Branch2][Ring1][#Branch1][N][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][=C][C][Branch1][C][F][=C][Ring1][O][O][C][=N][Ring2][Ring1][#C]
0
0
0
[ 2, 1365, 2404, 2388, 1279, 1708, 1465, 2131, 1394, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
10
[C][C][=N][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][N][C][=N][C][Branch1][=N][N][C][C][=C][C][Branch1][C][Br][=N][O][Ring1][=Branch1][=N][C][Branch2][Ring1][#Branch1][N][C][=C][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][=C][Ring1][#Branch2][C][=Branch1][C][=O][O][=N][Ring2][Ring1][N]
0
0
0
[ 2, 1274, 1276, 1478, 1325, 1374, 1434, 1323, 2457, 1408, 1342, 1302, 1369, 1499, 429, 1480, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
17
[C][C][N][=N][S][C][=Ring1][Branch1][C][N][C][=N][C][Branch1][P][N][C][C][C][=C][C][Branch1][C][Br][=C][Branch1][C][Br][S][Ring1][#Branch1][=N][C][Branch2][Ring1][Branch1][N][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][Branch1][C][F][=C][Ring1][O][=N][Ring2][Ring1][N]
0
0
0
[ 2, 1274, 424, 425, 1992, 1492, 1293, 1469, 1323, 1942, 2062, 1368, 2034, 1480, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
15
[C][C][=C][C][Branch2][Ring2][#C][N][C][=N][C][Branch2][Ring1][Ring1][N][C][C][=C][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][=C][Ring1][#Branch2][=N][C][Branch1][=C][N][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][Cl][=N][Ring2][Ring1][O][=C][N][=C][Ring2][Ring2][C][Br]
0
0
0
[ 2, 1349, 1500, 1849, 1546, 2160, 2044, 437, 1356, 421, 1611, 420, 443, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
14
[C][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][N][C][=N][C][Branch2][Ring1][C][N][C][C][C][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][C][C][O][Ring1][#Branch1][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][Branch1][C][I][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][=N]
0
0
0
[ 2, 1357, 1863, 1415, 1679, 1395, 1531, 1288, 2056, 1766, 1284, 451, 421, 1325, 1339, 425, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
17
[O][=C][Branch1][Ring1][N][Dy][C][=C][C][=C][Branch2][Branch1][Ring1][N][C][=N][C][Branch1][P][N][C][C][C][=C][O][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][=N][Ring1][N][=N][Ring2][Ring1][#C][C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][=C][Ring2][Ring2][O]
0
0
0
[ 2, 2668, 1311, 424, 435, 1286, 1449, 2455, 2984, 1671, 2769, 2020, 1388, 2699, 2505, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
16
[C][N][C][C][N][Branch2][Branch1][#Branch1][C][C][=C][C][=C][C][Branch2][Ring2][#Branch2][N][C][=N][C][Branch1][=C][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][F][=N][C][Branch1][#C][N][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][C][Ring1][#Branch1][=N][Ring2][Ring1][#Branch1][=C][Ring2][Ring1][=C][C][C][Ring2][Ring2][Branch1]
0
0
0
[ 2, 420, 2381, 1483, 2270, 1573, 1912, 2241, 1383, 1279, 1302, 1520, 1447, 1551, 421, 1274, 2082, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
18
[C][O][C][=Branch1][C][=O][C][S][C][=N][C][=Ring1][Branch1][N][C][=N][C][Branch2][Ring1][=Branch1][N][C][C][Branch1][C][C][C][C][C][Branch1][Branch1][C][C][Ring1][#Branch1][O][C][C][O][Ring1][#Branch1][=N][C][Branch2][Ring1][#Branch1][N][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][P]
0
0
0
[ 2, 2412, 1276, 1402, 1454, 1527, 1313, 2009, 1312, 1307, 1815, 1408, 1342, 1448, 1479, 1339, 439, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
18
[C][C][=C][C][=C][Branch2][Branch1][#Branch2][C][N][C][=N][C][Branch1][=C][N][C][=N][N][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=N][C][Branch2][Ring1][=N][N][C@H1][Branch2][Ring1][C][C][C][=C][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][#Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][S][N][=C][Ring2][Ring2][Branch2][C]
0
0
0
[ 2, 1357, 2465, 1358, 1758, 2450, 1292, 1385, 441, 1283, 1274, 1275, 1431, 1286, 1346, 1372, 1287, 1424, 1611, 428, 420, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
22
[O][=C][Branch1][Ring1][N][Dy][C][=N][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][N][C][=N][C][Branch2][Ring1][C][N][C][C][C][C][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][O][Ring1][Branch2][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][=N][Ring2][Ring1][=C]
0
0
0
[ 2, 2668, 1311, 424, 435, 420, 1433, 1323, 1325, 2447, 2257, 2134, 2310, 1472, 1379, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
16
[C][O][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][N][C][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=C][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=C][Ring1][N][=N][C][Branch2][Ring1][Branch1][N][C@H1][Branch1][O][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][P]
0
0
0
[ 2, 2408, 433, 1291, 423, 2536, 2210, 1406, 1634, 423, 1521, 437, 1339, 439, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
15
[C][N][Branch1][C][C][C][Branch2][=Branch1][#Branch1][C][N][C][=N][C][Branch2][Ring1][S][N][C][=C][C][=C][Branch2][Ring1][Ring2][B][O][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][C][Branch1][C][C][O][Ring1][=Branch2][C][=C][Ring1][#C][=N][C][Branch2][Ring1][#Branch1][N][C@H1][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=N][Ring2][Ring2][Ring2][C][=C][C][=C][O][Ring1][Branch1]
0
0
0
[ 2, 1633, 1332, 1487, 431, 420, 2187, 2269, 459, 1650, 1320, 1809, 2291, 1408, 1634, 1407, 2716, 1536, 2357, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
20
[C][C][=C][C][Branch2][Branch1][=Branch2][N][C][=N][C][Branch2][Ring1][Ring2][N][C][C@][Branch1][Ring1][C][O][C][O][C][C@H1][C][C][C][N][Ring1][Branch1][Ring1][O][=N][C][Branch2][Ring1][=Branch1][N][C][=C][C][Branch1][C][F][=C][Branch1][C][Br][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][S][=C][C][=C][Ring2][Ring2][#Branch1][F]
0
0
0
[ 2, 1349, 1510, 1354, 1279, 453, 1311, 2399, 441, 1715, 422, 1382, 1773, 1564, 1323, 1455, 433, 1882, 431, 432, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
21
[C][#C][C][C@H1][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][N][C][=N][C][Branch1][=C][N][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][Cl][=N][C][Branch1][O][N][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=N][Ring2][Ring1][#Branch1]
0
0
0
[ 2, 1592, 1912, 1511, 1880, 1476, 1303, 1816, 1447, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
10
[C][C][=C][O][N][=C][Ring1][Branch1][C][N][C][=N][C][Branch1][S][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][C][=N][Ring1][Branch2][=N][C][Branch2][Ring1][=Branch1][N][C][=C][Branch1][C][F][C][=C][C][Branch1][C][Br][=C][Ring1][Branch2][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][N]
0
0
0
[ 2, 1319, 429, 1955, 1340, 1750, 2149, 1418, 1301, 1293, 1323, 1389, 1339, 424, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
15
[C][O][C][=N][C][Branch1][C][C][=N][C][Branch2][Branch1][=Branch1][N][C][=N][C][Branch1][O][N][C][C][Branch1][C][C][Branch1][C][F][F][=N][C][Branch2][Ring1][=N][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][N][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][N][=N][Ring2][Ring2][Ring2]
0
0
0
[ 2, 2311, 1288, 1276, 1516, 1429, 1527, 1350, 1733, 1480, 1536, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
12
[C][N][C][C][N][Branch2][Branch1][S][C][C][=C][C][=C][Branch2][Ring2][O][N][C][=N][C][Branch1][#C][N][C][C][=Branch1][C][=O][N][C][=N][C][=C][S][Ring1][Branch1][=N][C][Branch1][#C][N][C][C][C][C@@H1][Ring1][Branch1][C][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#Branch2][C][=C][Ring2][Ring1][P][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring2][Ring2][N]
0
0
0
[ 2, 420, 2381, 2150, 1357, 1543, 1489, 2958, 1383, 1331, 440, 1528, 1287, 1355, 2619, 1437, 1274, 1300, 424, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
20
[C][O][C][=C][C][=C][Branch2][Ring2][#C][N][C][=N][C][Branch1][=C][N][C][C][C][Branch1][C][C][Branch1][Ring1][O][C][O][C][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][O][N][=C][Ring2][Ring2][C]
0
0
0
[ 2, 1334, 1500, 1358, 1790, 1698, 1294, 1544, 1470, 1339, 429, 1611, 420, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
14
[C][N][C][C][O][C@@H1][Branch2][Ring2][S][C][N][C][=N][C][Branch2][Ring1][C][N][C][C][C][C][C][N][Ring1][Branch1][C][=C][C][=C][N][=N][Ring1][=Branch1][=N][C][Branch1][#C][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][=N][C@@H1][Ring2][Ring2][Branch1][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1]
0
0
0
[ 2, 420, 1285, 429, 440, 2405, 1415, 1715, 1316, 1286, 424, 1622, 1383, 1338, 440, 1372, 1287, 1411, 440, 1300, 1288, 1795, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
23
[C][O][C][=Branch1][C][=O][C][=C][C][Branch2][Branch1][#Branch2][N][C][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][C][Branch2][Ring1][Branch2][N][C][=C][C][Branch1][Ring1][O][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][O][C][=N][Ring2][Ring1][P][=C][C][=C][Ring2][Ring2][Branch2][C]
0
0
0
[ 2, 1621, 1538, 2272, 2360, 1290, 2183, 2326, 1439, 1882, 428, 420, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
13
[C][O][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][Branch2][Ring2][S][N][C][=N][C][Branch1][=C][N][C][C][C][C][C][C][C][Ring1][Ring1][C][Ring1][#Branch1][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=C][Ring1][N][=N][Ring2][Ring1][N][=C][Ring2][Ring2][#Branch1]
0
0
0
[ 2, 1673, 1491, 2078, 2985, 2134, 2310, 1472, 2268, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
10
[C][C][=C][C][=C][Branch2][Branch1][Branch1][N][C][=N][C][Branch2][Ring1][=Branch1][N][C][=C][C][Branch1][C][F][=C][C][Branch1][C][F][=C][Ring1][Branch2][C][=Branch1][C][=O][N][Dy][=N][C][Branch1][P][N][C][=C][C][=C][N][=C][C][=N][C][Ring1][=Branch1][=C][Ring1][#Branch2][Br][=N][Ring2][Ring1][#C][C][Branch1][C][Cl][=N][Ring2][Ring2][#Branch1]
0
0
0
[ 2, 1357, 1493, 2577, 1982, 1290, 2596, 2261, 443, 2020, 1309, 1719, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
13
[C][O][C][Branch2][Branch1][Branch2][C][N][C][=N][C][Branch2][Ring1][=Branch1][N][C][C][Branch1][#Branch2][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][O][C][C][Ring1][O][=N][C][Branch2][Ring1][C][N][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][=N][Ring1][#Branch2][=N][Ring2][Ring1][=C][C][C][C][O][C][Ring1][Branch1]
0
0
0
[ 2, 1330, 2375, 2084, 1722, 1444, 1785, 1419, 2391, 1368, 1465, 1379, 2564, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
14
[C][#C][C][C@@H1][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][N][C][=N][C][Branch1][N][N][C][N][=N][N][Branch1][C][C][N][=Ring1][=Branch1][=N][C][Branch1][N][N][C][=C][C][Branch1][C][C][=N][O][Ring1][=Branch1][=N][Ring2][Ring1][Ring2]
0
0
0
[ 2, 1589, 1565, 1279, 424, 1385, 1288, 2481, 1503, 1317, 1288, 2457, 2151, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
14
[N-1][=N+1][=N][C][C][C][C@H1][Branch2][Branch1][C][N][C][=N][C][Branch2][Ring1][=Branch1][N][C][C][=N][C][=C][Branch1][C][F][C][Branch1][C][F][=C][C][=C][Ring1][Branch2][NH1][Ring1][O][=N][C][Branch1][=C][N][C][C][Branch1][Ring1][C][O][C][C][=C][C][Ring1][#Branch1][=N][Ring2][Ring1][N][C][=Branch1][C][=O][N][Dy]
0
0
0
[ 2, 468, 458, 425, 1313, 441, 1481, 1454, 1370, 2346, 1362, 2263, 1944, 1980, 2811, 1485, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
17
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][N][Branch2][Branch1][Ring2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=N][C][Branch1][O][N][C][C][C][=C][C][=N][O][Ring1][Branch1][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][=C][Ring1][O][=N][Ring2][Ring1][#Branch2][C][C][Ring2][Ring2][#Branch1]
0
0
0
[ 2, 2061, 1459, 1377, 1775, 2917, 1544, 1407, 1398, 1355, 1274, 2111, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
13
[O][=C][Branch1][Ring1][N][Dy][C@@H1][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][N][Ring1][O][C][=N][C][Branch2][Ring1][#Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][=N][C][Branch1][=N][N][C][=N][C][=C][C][=Branch1][C][=O][NH1][Ring1][#Branch1][=N][Ring2][Ring1][#Branch2]
0
0
0
[ 2, 2668, 1311, 424, 435, 440, 1357, 1511, 1325, 1633, 422, 1294, 1408, 2949, 2624, 2421, 1355, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
18
[C][C][=C][C][=C][C][S][C][Branch2][Branch1][Branch1][N][C][=N][C][Branch2][Ring1][=Branch1][N][C][C][Branch1][Branch1][O][C][C][O][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][O][=N][C][Branch1][P][N][C@H1][C][C][C@@H1][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][Ring1][=Branch2][=N][Ring2][Ring1][=N][=N][C][Ring2][Ring2][#Branch1][=Ring2][Ring2][Ring1]
0
0
0
[ 2, 2270, 1337, 1493, 1454, 2916, 1378, 1634, 1274, 440, 1368, 1343, 1411, 1276, 2111, 450, 1413, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
18
[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Branch1][=Branch1][N][C][=N][C][Branch1][#C][N][C][C][=N][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][O][=N][C][Branch2][Ring1][=Branch2][N][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][=C][Branch1][C][Cl][C][Branch1][C][Br][=C][Ring1][N][F][=N][Ring2][Ring1][=C][C][=C][Ring2][Ring2][Branch1][O][C]
0
0
0
[ 2, 1554, 1516, 1489, 2562, 429, 1484, 1318, 1302, 1275, 1501, 1323, 1472, 432, 1379, 1327, 2582, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
18
[C][C][Branch2][Branch1][Ring2][C][N][C][=N][C][Branch1][P][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][Ring1][C][#N][=C][Ring1][=Branch2][=N][C][Branch2][Ring1][Ring2][N][C@H1][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][C][=C][C][=C][S][Ring1][Branch1][=N][Ring2][Ring1][=N][S][Branch1][C][N][=Branch1][C][=O][=O]
0
0
0
[ 2, 1274, 2395, 1366, 3013, 1363, 1634, 1407, 1357, 1530, 1411, 433, 2689, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
14
[C][O][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][=C][Branch2][Branch1][N][N][C][=N][C][Branch1][=N][N][C][C][Branch1][C][C][N][C][C][C][Ring1][Ring2][=N][C][Branch2][Ring1][P][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=N][=N][Ring2][Ring2][C][C][=N][Ring2][Ring2][=N]
0
0
0
[ 2, 1505, 1789, 1374, 1527, 2696, 1874, 1303, 1333, 1285, 2368, 425, 2527, 1322, 425, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
16
[C][C][Branch1][C][C][C][N][C][=N][C][=C][Branch2][Ring2][=C][N][C][=N][C][Branch1][S][N][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][=Branch2][=N][C][Branch1][P][N][C@H1][C][C][C@@H1][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][Ring1][=Branch2][=N][Ring2][Ring1][O][N][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring2][Ring2][=Branch1][Ring2][Ring2][=Branch2]
0
0
0
[ 2, 1274, 1332, 1401, 1514, 2524, 1809, 1378, 1634, 1274, 440, 1368, 1343, 1356, 1315, 1473, 1308, 2655, 2027, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
20
[C][C][=C][C][=C][Branch2][Branch1][=Branch1][N][C][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=C][C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][=C][Ring1][#Branch2][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][=N][N][=N][Ring2][Ring2][Ring2]
0
0
0
[ 2, 1357, 1516, 2536, 1545, 1369, 2572, 2044, 1339, 1385, 1536, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
12
[C][C][=C][S][C][=C][Ring1][Branch1][C][N][C][=N][C][Branch2][Ring1][Ring1][N][C][C][=N][N][=C][C][=Branch1][C][=O][NH1][C][=C][N][Ring1][#Branch2][Ring1][#Branch1][=N][C][Branch2][Ring1][#Branch1][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][I][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][S]
0
0
0
[ 2, 1319, 2158, 2161, 2846, 2033, 1284, 451, 1325, 1339, 433, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
12
[C][O][C][=Branch1][C][=O][C][=C][C][Branch2][Branch1][Ring1][N][C][=N][C][Branch1][P][N][C][C][C][=C][O][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#C][=C][S][Ring2][Ring2][Branch1]
0
0
0
[ 2, 1621, 1449, 2455, 2984, 1671, 1420, 1455, 438, 1560, 2082, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
12
[O][=C][Branch1][Ring1][N][Dy][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][C][=N][C][Branch2][Ring1][Branch1][N][C][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][=N][C][Branch1][=C][N][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][Cl][=N][Ring2][Ring1][O]
0
0
0
[ 2, 2668, 1311, 424, 435, 1286, 1515, 2402, 1369, 1638, 2229, 1356, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
13
[O][=C][Branch1][Ring1][N][Dy][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][N][C][=N][C][Branch1][=N][N][C][C][=C][NH1][C][=Branch1][C][=O][N][=Ring1][#Branch1][=N][C][Branch2][Ring1][#Branch2][N][C][=N][C][Branch1][S][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=Branch2][=C][S][Ring1][=C][=N][Ring2][Ring1][=N]
0
0
0
[ 2, 2668, 1311, 424, 435, 1473, 1309, 1430, 2087, 2080, 2105, 1512, 1340, 1473, 1448, 1479, 1560, 2045, 1411, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
20
[C][O][C][=C][N][=C][Branch2][Ring2][=C][N][C][=N][C][Branch1][=N][N][C][=C][C][=N][C][Branch1][C][C][=C][Ring1][#Branch1][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#Branch2][C][=N][Ring2][Ring1][P]
0
0
0
[ 2, 2392, 1514, 1940, 1276, 2044, 2694, 1325, 1339, 2415, 1439, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
12
[C][C][S][C][Branch1][C][C][=C][Branch2][Branch1][#Branch2][C][N][C][=N][C][Branch2][Ring1][C][N][C][=C][C][=C][NH1][C][=Branch1][C][=O][NH1][C][Ring1][=Branch1][=C][Ring1][#Branch2][=N][C][Branch2][Ring1][Branch2][N][C@@H1][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][Cl][=N][Ring2][Ring1][S][C][=Ring2][Ring2][Branch2][Br]
0
0
0
[ 2, 1274, 1337, 1425, 2465, 2474, 2277, 1675, 1466, 1518, 1407, 1473, 1309, 1430, 437, 2157, 1847, 428, 443, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
20
[C][N][C][C][Branch2][Branch1][=Branch1][C][C][N][C][=N][C][Branch2][Ring1][C][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][Ring1][#Branch2][=O][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#C][C][C][Ring2][Ring2][#Branch1][=O]
0
0
0
[ 2, 420, 1285, 1516, 1274, 1415, 2726, 1544, 1885, 1339, 1694, 2111, 430, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
14
[C][#C][C][C@@][Branch1][C][C][Branch2][Branch1][Branch1][N][C][=N][C][Branch1][=C][N][C][=C][N][=C][Branch1][Ring1][O][C][N][=C][Ring1][Branch2][=N][C][Branch2][Ring1][=Branch2][N][C][=C][C][=C][Branch1][=C][C][N][C][C][N][Branch1][Ring1][C][C][C][C][Ring1][Branch2][C][=N][Ring1][#C][=N][Ring2][Ring1][#C][C][=Branch1][C][=O][N][Dy]
0
0
0
[ 2, 1591, 1493, 2659, 1698, 1625, 1484, 1721, 1305, 2381, 1311, 1399, 1950, 425, 422, 438, 1684, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
18
[C][N][C][=C][C][Branch2][=Branch1][Ring1][N][C][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][=C][Ring1][O][=N][C][Branch2][Ring1][P][N][C][=C][C][=C][Branch2][Ring1][Ring2][N][C][C][C][=C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][Ring1][N][=O][C][=C][Ring2][Ring1][Ring1][=N][Ring2][Ring2][=Branch1][=N][Ring2][Ring2][N]
0
0
0
[ 2, 420, 1317, 2463, 1820, 1407, 1398, 1874, 2874, 1690, 1322, 424, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
13
[C][N][C][=C][Branch2][=Branch1][Ring2][C][N][C][=N][C][Branch2][Ring1][O][N][C][C][Branch1][C][O][C][C][C][C][C][C][Ring1][Branch1][C][C][Ring1][Branch2][C][Ring1][Branch1][C][Ring1][#Branch1][Ring1][N][=N][C][Branch2][Ring1][=Branch2][N][C@@H1][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][=N][Ring2][Ring2][Ring2][C][Branch1][C][Br][=N][Ring2][Ring2][N]
0
0
0
[ 2, 420, 1318, 2196, 420, 1927, 2519, 1399, 1528, 1950, 1463, 1312, 1410, 1484, 1518, 1407, 2270, 1420, 1389, 1536, 420, 1323, 1322, 424, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
25
[C][C][=C][C][=C][Branch2][#Branch1][=Branch2][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][C][Branch2][=Branch1][Ring1][O][C][C][N][C][=N][C][Branch2][Ring1][O][N][C][C][Branch1][C][O][C][C][C][C][C][C][Ring1][Branch1][C][C][Ring1][Branch2][C][Ring1][Branch1][C][Ring1][#Branch1][Ring1][N][=N][C][Branch2][Ring1][=Branch1][N][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][=C][C][Branch1][C][C][=C][Ring1][O][C][=N][Ring2][Ring1][P][=N][Ring2][Ring2][#C][C][=C][Ring2][Branch1][Branch1]
0
0
0
[ 2, 1357, 428, 431, 434, 1293, 1468, 1276, 2463, 1307, 1927, 2519, 1399, 1528, 1950, 1463, 1312, 1410, 1899, 1439, 1322, 438, 1275, 427, 423, 423, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
27
[C][C][C][C][C][N][=C][Branch2][Ring2][=C][C][N][C][=N][C][Branch1][=N][N][C][C][C][Branch1][C][C][S][Branch1][C][C][=O][=N][C][Branch2][Ring1][C][N][C@H1][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][C][C][C][C][Ring1][Branch1][=N][Ring2][Ring1][=Branch2][S][C][=Ring2][Ring1][S][C][Ring2][Ring2][Ring2]
0
0
0
[ 2, 1547, 1315, 1304, 1305, 2642, 1761, 1371, 1667, 1547, 1316, 1375, 1337, 450, 422, 1337, 1996, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
18
[C][O][C][=C][C][=C][C][Branch2][Branch1][Branch1][N][C][=N][C][Branch2][Ring1][#Branch1][N][C][C][=C][N][Branch1][=Branch1][C][Branch1][C][F][F][C][=C][C][=C][C][=C][Ring1][N][Ring1][=Branch1][=N][C][Branch1][S][N][C][=C][C][Branch1][C][C][=C][Branch1][C][Cl][N][=N][Ring1][Branch2][=N][Ring2][Ring1][=N][=C][Ring2][Ring2][Ring2][C][=Branch1][C][=O][N][Dy]
0
0
0
[ 2, 1474, 1493, 1624, 2755, 1386, 1800, 1309, 424, 1435, 2623, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
12
[O][=C][Branch1][Ring1][N][Dy][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][I][C][=C][Ring1][#Branch1][N][C][=N][C][Branch1][S][N][C][C][=N][C][=C][N][=C][C][=C][Ring1][=Branch1][S][Ring1][=Branch2][=N][C][Branch2][Ring1][Branch1][N][C][=C][C][=C][C][Branch1][#Branch2][C][N][C][C][C][C][C][Ring1][=Branch1][=C][Ring1][=N][=N][Ring2][Ring1][#C]
0
0
0
[ 2, 2668, 1311, 424, 435, 441, 423, 2029, 1284, 451, 1325, 1827, 2404, 1751, 1406, 1342, 1722, 1540, 1308, 1641, 1394, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
22
[O][=C][Branch1][Ring1][N][Dy][C][=N][C][Branch1][C][Cl][=C][C][Branch2][Ring2][Branch2][N][C][=N][C][Branch1][S][N][C][C][=N][C][=C][C][NH1][C][=C][C][Ring1][=Branch2][=Ring1][Branch1][=N][C][Branch1][O][N][C][=N][C][=N][C][=C][Ring1][=Branch1][Br][=N][Ring2][Ring1][=Branch2][=C][Ring2][Ring1][P][Cl]
0
0
0
[ 2, 2668, 1311, 424, 435, 420, 1603, 1305, 1677, 1827, 1293, 2246, 1476, 2240, 443, 1375, 1966, 437, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
19
[C][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][C][N][C][=N][C][Branch2][Ring1][P][N][C][=N][NH1][C][=C][Ring1][Branch1][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][Ring1][N][Branch1][C][C][C][=N][C][Branch2][Ring1][#Branch1][N][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring2][=Branch1]
0
0
0
[ 2, 1357, 1414, 1387, 1274, 2001, 2135, 1506, 1410, 1332, 1408, 1634, 423, 2029, 1470, 1290, 1690, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
18
[C][C][=C][C][=C][Branch1][C][C][C][Branch2][Branch1][Branch1][C][N][C][=N][C][Branch2][Ring1][Ring1][N][C][=N][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][S][Ring1][O][=N][C][Branch2][Ring1][C][N][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][C][O][C][C][Ring1][#Branch2][=N][Ring2][Ring1][=N][=N][Ring2][Ring2][=Branch1]
0
0
0
[ 2, 1357, 1332, 2307, 1359, 1599, 1687, 1560, 1419, 1371, 1279, 1302, 1785, 1344, 1411, 1690, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
17
[C][C][Branch1][C][C][Branch1][O][C][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][N][C][=N][C][Branch2][Ring2][Ring2][N][C][C][=N][N][Branch2][Ring1][Branch2][C][C][C][N][Branch1][=C][C][=Branch1][C][=O][O][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][=N][C][=Ring2][Ring1][C][=N][C][Branch2][Ring1][#Branch1][N][C][=C][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][=C][Ring1][#Branch2][C][=Branch1][C][=O][O][=N][Ring2][Ring2][#Branch1]
0
0
0
[ 2, 1526, 1962, 1444, 420, 1281, 1864, 2464, 1283, 428, 1313, 2368, 2639, 2013, 1408, 1342, 1302, 1369, 1499, 429, 1719, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
22
[C][C][O][C][=Branch1][C][=O][C][=C][N][=C][N][=C][Ring1][=Branch1][N][C][=N][C][Branch1][P][N][C][=N][C][Branch1][C][C][=N][C][Branch1][Ring1][O][C][=N][Ring1][=Branch2][=N][C][Branch2][Ring1][Branch2][N][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#C]
0
0
0
[ 2, 1994, 1414, 1366, 2632, 1299, 422, 1294, 1918, 2492, 2612, 1339, 438, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
14
[C][C][O][C][=Branch1][C][=O][C][=N][N][=C][Branch2][Branch1][=C][N][C][=N][C][Branch2][Ring1][Ring2][N][C][C][=C][C][=C][C][Branch1][Branch2][N][C][=C][N][=N][Ring1][Branch1][=C][Ring1][O][=N][C][Branch2][Ring1][O][N][C@@H1][Branch1][P][C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring2][Ring1][O][Ring2][Ring2][=Branch2]
0
0
0
[ 2, 2205, 1757, 1948, 1354, 1563, 1345, 1318, 2245, 1376, 1656, 1697, 2030, 1448, 1568, 1290, 1322, 1419, 2027, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
20
[C][C][=C][N][=C][Branch1][C][O][C][Branch2][Branch1][Ring2][N][C][=N][C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][F][=N][Ring1][#Branch1][=N][C][Branch2][Ring1][=Branch2][N][C][=C][C][Branch1][Branch2][N][C][=C][C][=N][Ring1][Branch1][=C][C][=C][Ring1][O][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][=C][=C][Ring2][Ring2][=Branch1]
0
0
0
[ 2, 2143, 1488, 1459, 1374, 1342, 1301, 1417, 1484, 1317, 1345, 1317, 1577, 421, 1398, 1339, 421, 2655, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
19
[O][=C][Branch1][Ring1][N][Dy][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Ring1][=Branch2][C][=N][C][Branch1][S][N][C][C][=C][C][=C][S][C][=N][C][Ring1][Branch1][=C][Ring1][=Branch2][=N][C][Branch1][S][N][C][=N][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][S][Ring1][Branch2][=N][Ring2][Ring1][#Branch2]
0
0
0
[ 2, 2668, 1311, 424, 435, 1978, 424, 1819, 1386, 1367, 1337, 1276, 1762, 2439, 3025, 1355, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
17
[O][=C][Branch1][Ring1][N][Dy][C][C][=N][N][Branch1][Ring2][C][C][O][C][=Ring1][Branch2][N][C][=N][C][Branch1][=N][N][C][C][C][C][N][C][C][C][C][Ring1][Branch1][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][=N][Ring1][N][=N][Ring2][Ring1][=N]
0
0
0
[ 2, 2668, 1311, 424, 435, 1274, 1385, 1395, 1274, 1294, 2299, 2663, 1578, 1671, 2769, 1411, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
17
[C][C][=C][C][=Branch1][C][=O][O][C][=C][C][Branch2][Ring2][P][N][C][=N][C][Branch2][Ring1][C][N][C][=N][C][Branch1][C][Br][=C][N][C][=C][N][=C][Ring1][#Branch2][Ring1][Branch1][=N][C][Branch1][P][N][C][C@@H1][Branch1][C][O][C][C@@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][O][=C][C][=C][Ring2][Ring2][#Branch1][Ring2][Ring2][C]
0
0
0
[ 2, 1349, 1278, 429, 1293, 1458, 1341, 1281, 2425, 1378, 1498, 1488, 440, 1372, 1287, 1356, 1882, 431, 2445, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
20
[C][C][=N][C][Branch2][Ring2][Branch2][C][N][C][=N][C][Branch1][O][N][C][C][=C][N][=C][N][Ring1][Branch1][C][=N][C][Branch1][#C][N][C][C][C][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][Branch2][=C][C][=C][Ring2][Ring1][S][C][Branch1][C][C][O]
0
0
0
[ 2, 1274, 1276, 1677, 420, 1429, 1615, 1768, 1383, 1338, 441, 1372, 1287, 1403, 421, 1720, 1337, 1288, 429, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
20
[N][#C][C][=C][C][=C][Branch2][Branch1][Ring2][N][C][=N][C][Branch1][=C][N][C][C][C][C][C][C][C][Ring1][Ring1][C][Ring1][#Branch1][=N][C][Branch2][Ring1][Branch2][N][C][=C][C][=C][Branch1][Ring1][C][#N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][N][=N][Ring2][Ring1][N][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][=C][Ring2][Ring2][#Branch1]
0
0
0
[ 2, 424, 438, 1286, 1459, 2078, 2985, 2675, 2239, 2633, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
11
[O][=C][Branch1][Ring1][N][Dy][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][N][C][=N][C][Branch1][=Branch2][N][C][C][=C][Branch1][C][Cl][Cl][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][=C][Ring1][O][=N][Ring2][Ring1][Branch2]
0
0
0
[ 2, 2668, 1311, 424, 435, 1293, 2284, 2332, 2996, 2572, 2238, 1376, 1403, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
14
[C][O][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][N][C][=N][C][Branch1][=C][N][C][C][Branch1][Ring1][C][O][C][C][O][C][Ring1][#Branch1][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][=C][C][=C][Ring1][#Branch2][C][=N][Ring2][Ring1][O]
0
0
0
[ 2, 1423, 2284, 2592, 2271, 2010, 1356, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
8
[C][C][S][C][Branch2][Branch1][P][N][C][=N][C][Branch2][Ring1][Ring1][N][C][C][N][C][C][C][Branch1][Ring2][C][Ring1][Branch1][O][C][C][O][Ring1][=Branch1][=N][C][Branch2][Ring1][#C][N][C@H1][Branch2][Ring1][Ring2][C][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring2][Ring1][=C][Branch1][Ring1][C][#N][C][=Ring2][Ring2][O][C]
0
0
0
[ 2, 1274, 1337, 2091, 1706, 1331, 1837, 1316, 2264, 2287, 1634, 1283, 427, 1357, 1468, 1346, 2585, 421, 1651, 1847, 1294, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
22
[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][Branch2][Branch1][C][N][C][=N][C][Branch1][P][N][C][C@@H1][C][C@@H1][O][C@H1][Ring1][Branch1][C@H1][C][C@H1][Ring1][Ring1][Ring1][=Branch1][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][=C][Ring1][O][=N][Ring2][Ring1][N][=N][Ring2][Ring2][Ring1]
0
0
0
[ 2, 1365, 1473, 1481, 1366, 2983, 1544, 1407, 1398, 1480, 1490, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
12
[C][N][C][C][N][Branch2][=Branch1][=Branch1][C][C][=C][C][=C][C][Branch2][Branch1][=Branch2][N][C][=N][C][Branch2][Ring1][C][N][C][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][C][C][Ring1][=Branch2][=N][C][Branch2][Ring1][Branch2][N][C@H1][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=N][Ring2][Ring1][S][=C][Ring2][Ring2][#Branch1][C][C][Ring2][Ring2][=C]
0
0
0
[ 2, 420, 2381, 1487, 426, 2270, 1510, 1415, 1623, 1748, 1466, 1634, 1407, 1357, 1470, 1424, 2276, 1274, 1300, 421, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
21
[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][O][=C][C][Branch2][Branch1][=Branch1][N][C][=N][C][Branch2][Ring1][Ring2][N][C][C][=C][C][=C][C][Branch1][Branch2][N][C][=C][N][=N][Ring1][Branch1][=C][Ring1][O][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#C][=C][Ring2][Ring2][#Branch1]
0
0
0
[ 2, 1621, 2590, 1516, 1354, 1563, 1345, 1318, 2245, 1376, 1544, 1470, 1339, 438, 2276, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
16
[C][C][N][=N][S][C][=Ring1][Branch1][C][N][C][=N][C][Branch2][Ring1][O][N][C][C@H1][C][C@H1][Branch1][#C][C][=N][N][=C][Branch1][=Branch1][C][Branch1][C][C][C][NH1][Ring1][Branch2][C][C@H1][Ring1][=N][O][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][Branch1][C][I][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring2][C]
0
0
0
[ 2, 1274, 424, 425, 1992, 1927, 1952, 1674, 423, 1336, 1757, 1497, 1332, 2128, 1674, 422, 1523, 1544, 1284, 451, 1325, 2610, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
23
[O][=C][Branch1][Ring1][N][Dy][C][=C][Branch1][C][Br][C][=C][C][Branch1][C][F][=C][Ring1][Branch2][N][C][=N][C][Branch1][#C][N][C][C][N][C][C][C][S][Ring1][Branch1][=Branch1][C][=O][=O][=N][C][Branch1][S][N][C][=N][C][=C][C][=C][C][=C][N][=C][Ring1][#Branch2][Ring1][=Branch1][=N][Ring2][Ring1][O]
0
0
0
[ 2, 2668, 1311, 424, 435, 2177, 1293, 1769, 1489, 1331, 1530, 1421, 1386, 1725, 1926, 1308, 1356, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
18
[C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Branch1][=N][N][C][=N][C][Branch1][S][N][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][=N][C][Branch2][Ring1][#C][N][C@H1][Branch2][Ring1][Ring2][C][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring1][N][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring2][Ring2][C][=C][Ring2][Ring2][O][O][C]
0
0
0
[ 2, 1554, 1861, 1608, 1978, 1343, 2287, 1634, 1283, 427, 1357, 1619, 1291, 1397, 1536, 1327, 429, 1294, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
19
[C][C][=C][C][=C][Branch2][Ring2][#Branch1][N][C][=N][C][Branch1][S][N][C][C][=N][C][Branch1][C][C][=C][Branch1][C][C][S][Ring1][#Branch1][=N][C][Branch1][#Branch2][N][C][=C][N][=C][C][=N][Ring1][=Branch1][=N][Ring2][Ring1][=Branch1][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][=C][Ring2][Ring1][P]
0
0
0
[ 2, 1357, 1772, 1608, 2533, 1636, 2893, 2605, 1302, 1966, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
11
[C][C][=C][Branch1][C][F][C][=C][C][=C][Ring1][#Branch1][N][C][=N][C][Branch1][P][N][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][O][C][C][Ring1][#Branch1][=N][C][Branch2][Ring1][C][N][C@@H1][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][C][C][C][C][Ring1][Branch1][=N][Ring2][Ring1][O]
0
0
0
[ 2, 1319, 2042, 1366, 1401, 2345, 1371, 1518, 1302, 1547, 1316, 1356, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
13
[C][C][O][C][=Branch1][C][=O][C][=C][N][=C][Branch2][Branch1][#Branch1][N][C][=N][C][Branch2][Ring1][Branch2][N][C][=C][C][=C][Branch1][Ring1][C][#N][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][N][=N][C][Branch1][P][N][C@@H1][Branch1][#Branch1][C][C][C][N][=N+1][=N-1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#C][C][=N][Ring2][Ring2][=Branch1]
0
0
0
[ 2, 1994, 1483, 1502, 1303, 2239, 1378, 1518, 1297, 1715, 458, 462, 1339, 1336, 1690, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
16
[N][#C][C][=C][C][Branch2][Branch1][=Branch1][N][C][=N][C][Branch2][Ring1][Ring2][N][C][C][=N][O][C][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][=N][Ring1][O][=N][C][Branch2][Ring1][Ring1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#C][=C][C][=C][Ring2][Ring2][=Branch1][F]
0
0
0
[ 2, 424, 438, 1293, 1516, 2432, 2759, 1361, 1939, 1339, 438, 1882, 426, 432, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
15
[C][N][Branch1][C][C][C][Branch2][Ring2][#Branch2][C][N][C][=N][C][Branch1][=Branch2][N][C][C][=C][Branch1][C][Cl][Cl][=N][C][Branch2][Ring1][C][N][C@H1][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][C][=C][S][C][=Ring1][Branch1][=N][Ring2][Ring1][#Branch1][C][C][S][C][Ring2][Ring1][=C]
0
0
0
[ 2, 1633, 1332, 1573, 420, 2332, 2996, 1371, 1667, 2549, 1447, 1274, 1337, 1413, 421, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
16
[C][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][=C][Ring1][#Branch2][N][C][=N][C][Branch1][#Branch1][N][C][C][C][C][F][=N][C][Branch2][Ring1][Branch2][N][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][Branch1][C][C][O][C][Branch1][C][C][Branch1][C][C][C][=N][Ring2][Ring1][=Branch2]
0
0
0
[ 2, 1357, 2581, 2130, 3001, 1807, 1375, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
8
[C][#C][C][O][C][=C][C][=C][C][Branch2][Branch1][Branch1][C][N][C][=N][C][Branch1][#C][N][C][C][N][C][C][C][C][C][Ring1][=Branch1][C][Ring1][Branch1][=N][C][Branch2][Ring1][#Branch1][N][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][=C][=C][Ring2][Ring2][=Branch1]
0
0
0
[ 2, 2701, 2307, 1489, 1540, 2255, 1408, 1317, 2661, 1568, 1339, 421, 2655, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
14
[C][N][C][=C][C][Branch2][Branch1][N][N][C][=N][C][Branch2][Ring1][Branch1][N][C][=C][C][=C][C][Branch1][#Branch2][N][S][Branch1][C][C][=Branch1][C][=O][=O][=C][Ring1][O][=N][C][Branch2][Ring1][Branch2][N][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][=C][C][=C][C][=C][C][=C][Ring1][=C][Ring1][=Branch1][=N][Ring2][Ring1][P][=N][Ring2][Ring2][#Branch1]
0
0
0
[ 2, 420, 1317, 1789, 2669, 2278, 1376, 1466, 1318, 1302, 1286, 1286, 422, 2037, 1439, 1719, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
17
[C][C][N][=N][S][C][=Ring1][Branch1][C][N][C][=N][C][Branch2][Ring1][C][N][C][C][=Branch1][C][=O][N][C][C][N][Branch1][C][C][C][C][Ring1][#Branch1][=N][C][Branch2][Ring1][C][N][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][C][O][C][C][Ring1][#Branch2][=N][Ring2][Ring1][N]
0
0
0
[ 2, 1274, 424, 425, 1992, 1415, 2323, 1371, 1279, 1302, 1785, 1344, 1480, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
14
[C][N][Branch2][Ring2][=Branch2][C][C][N][C][=N][C][Branch1][=Branch2][N][C][N][=C][NH1][N][=Ring1][Branch1][=N][C][Branch1][P][N][C@@H1][Branch1][#Branch1][C][C][C][N][=N+1][=N-1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][Branch2][C][C][C][O][C][C][Ring1][=Branch1]
0
0
0
[ 2, 1633, 1626, 1274, 1599, 2022, 2420, 1378, 1518, 1297, 1715, 458, 462, 1339, 428, 1991, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
17
[C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch2][Branch1][Ring2][N][C][=N][C][Branch2][Ring1][C][N][C][C][=C][C][Branch1][C][F][=C][Branch1][C][Cl][C][=C][Ring1][Branch2][F][=N][C][Branch2][Ring1][Ring1][N][C][=C][N][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][=N][C][=C][Ring2][Ring2][Ring2][F]
0
0
0
[ 2, 420, 1787, 1459, 2431, 2461, 2454, 1361, 1428, 1470, 1339, 425, 2162, 432, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
15
[C][#C][C][C@H1][Branch2][Branch1][C][N][C][=N][C][Branch2][Ring1][Ring2][N][C][C][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][NH1][N][=Ring1][O][=N][C][Branch1][S][N][C][=C][C][=C][Branch1][C][O][C][Branch1][C][C][=C][Ring1][Branch2][=N][Ring2][Ring1][N][C][=Branch1][C][=O][N][Dy]
0
0
0
[ 2, 1519, 1481, 2374, 2252, 1862, 1488, 1945, 1485, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
10
[C][C][Branch1][C][O][Branch2][Branch1][=Branch1][C][N][C][=N][C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][F][=N][Ring1][#Branch1][=N][C][Branch2][Ring1][#Branch2][N][C][=C][C][=C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][=C][Ring1][#Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring2][Ring1][=N][C][N][C][C][O][C][C][Ring1][=Branch1]
0
0
0
[ 2, 1274, 1511, 2260, 1374, 1342, 1301, 1417, 1512, 1303, 1593, 1437, 1460, 1467, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
15
[C][#C][C][O][C][=C][C][=C][Branch2][Branch1][S][C][N][C][=N][C][Branch2][Ring1][C][N][C][=C][C][=C][C][Branch1][#Branch1][C][=C][N][Ring1][Branch1][C][=C][Ring1][#Branch2][=N][C][Branch2][Ring1][=C][N][C@H1][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][=N][Ring2][Ring2][C][C][=C][Ring2][Ring2][#Branch2]
0
0
0
[ 2, 1831, 1655, 1337, 2388, 1679, 2309, 1606, 1634, 1407, 1286, 1468, 1346, 1322, 1319, 2471, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
17
[O][=C][Branch1][Ring1][N][Dy][C@H1][Branch2][Ring1][Ring1][C][C][=C][C][Branch1][C][F][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][=Branch2][N][C][=N][C][Branch1][=N][N][C][C][=C][NH1][C][=Branch1][C][=O][C][=Ring1][#Branch1][=N][C][Branch2][Ring1][C][N][C][=C][C][=C][NH1][C][=Branch1][C][=O][NH1][C][Ring1][=Branch1][=C][Ring1][#Branch2][=N][Ring2][Ring1][=Branch2]
0
0
0
[ 2, 2668, 1311, 424, 435, 441, 1283, 422, 1349, 2739, 2087, 2282, 2105, 2391, 2277, 1675, 1375, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
18
[C][C][Branch1][C][C][C][C][Branch2][Branch1][=C][C][C][N][C][=N][C][Branch2][Ring1][#Branch2][N][C][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][C][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][Ring1][=Branch2][=N][C][Branch2][Ring1][Ring1][N][C][C][C][C][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][C][C][Ring1][#Branch2][=N][Ring2][Ring2][Ring1][C][=Branch1][C][=O][N][Ring2][Ring2][=N]
0
0
1
[ 2, 1890, 1948, 1274, 1894, 1764, 1331, 2259, 1361, 1540, 1302, 2232, 1490, 420, 1280, 1300, 425, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 1 ]
18
[C][O][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch2][Branch1][O][N][C][=N][C][Branch2][Ring1][Ring2][N][C][C][=C][C][=C][Branch1][#Branch1][C][=C][Ring1][=Branch1][O][C][O][C][O][Ring1][=Branch2][=N][C][Branch2][Ring1][Branch2][N][C@@H1][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][=N][Ring2][Ring2][C][=C][Ring2][Ring2][O]
0
0
0
[ 2, 1334, 1360, 1704, 1947, 1297, 1333, 1294, 1294, 1809, 1466, 1518, 1407, 1357, 1323, 1325, 1322, 1327, 429, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
20
[C][O][C][Branch2][Branch1][=Branch2][C][N][C][=N][C][Branch2][Ring1][C][N][C][C][=C][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][C][S][C][Ring1][#Branch1][=N][C][Branch2][Ring1][#Branch1][N][C@@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][Br][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#C][C][C][C][Ring2][Ring2][Branch1]
0
0
0
[ 2, 1330, 2378, 1341, 1367, 1953, 1337, 1312, 2033, 1323, 1325, 1339, 438, 1313, 2082, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
16
[C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Branch1][C][Cl][C][=C][Ring1][#Branch2][N][C][=N][C][Branch1][N][N][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][=N][C][Branch2][Ring1][#Branch2][N][C@@H1][Branch1][S][C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][N]
0
0
0
[ 2, 1349, 1448, 1649, 1346, 1565, 2464, 1648, 1512, 1697, 433, 1357, 1301, 2218, 1339, 424, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
17
[C][C][=C][N][Branch2][=Branch1][N][C][=C][C][Branch2][Branch1][=Branch1][N][C][=N][C][Branch1][P][N][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][O][C][C][Ring1][#Branch1][=N][C][Branch2][Ring1][#Branch1][N][C][=C][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][=C][Ring1][#Branch2][C][=Branch1][C][=O][O][=N][Ring2][Ring1][=C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring2][Ring2][=Branch2][C][=N][Ring2][Ring2][=C]
0
0
0
[ 2, 1319, 424, 1487, 1317, 1516, 1366, 1401, 2345, 1408, 1342, 1302, 1369, 1499, 429, 1379, 2059, 2690, 420, 1322, 421, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
22
[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=N][C][Branch1][C][Cl][=C][Ring1][Branch2][N][C][=N][C][Branch1][=C][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][Cl][=N][C][Branch2][Ring1][Ring1][N][C][Branch1][Branch2][C][C][=Branch1][C][=O][N][Dy][C][C][C][C][C][Ring1][O][=N][Ring2][Ring1][O]
0
0
0
[ 2, 1621, 1309, 2163, 1912, 1515, 437, 1361, 1974, 1547, 1419, 1356, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
13
[C][=C][C][C@@H1][Branch2][Ring2][P][N][C][=N][C][Branch1][#C][N][C][C][C][C][=C][C][=Branch1][C][=O][NH1][NH1][Ring1][=Branch1][=N][C][Branch2][Ring1][Ring2][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Ring1][#Branch1][=N][Ring2][Ring1][O][C][=Branch1][C][=O][N][Dy]
0
0
0
[ 2, 1604, 1458, 1951, 2862, 1363, 2797, 1504, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
9
[C][O][C][=C][C][=N][C][=C][Ring1][=Branch1][C][N][C][=N][C][Branch2][Ring1][=Branch2][N][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][Branch1][#Branch1][C][=Branch1][C][=O][N][Dy][=C][Ring1][=N][=N][C][Branch1][#C][N][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][=Branch2][=N][Ring2][Ring1][=C]
0
0
0
[ 2, 1423, 1957, 1598, 2243, 1302, 1641, 2442, 1751, 1379, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
11
[O][=C][Branch1][Ring1][N][Dy][C][=C][C][=C][Branch1][C][Cl][N][=C][Ring1][#Branch1][N][C][=N][C][Branch1][#Branch2][N][C][C][C][=C][S][C][=Ring1][Branch1][=N][C][Branch1][S][N][C][=N][C][Branch1][C][F][=C][C][Branch1][C][F][=N][Ring1][Branch2][=N][Ring2][Ring1][=Branch1]
0
0
0
[ 2, 2668, 1311, 424, 435, 1286, 1885, 2551, 1682, 2676, 1647, 1301, 1435, 1784, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
15
[C][C][=C][C][=C][Branch1][C][O][C][Branch2][Branch1][=Branch2][C][N][C][=N][C][Branch2][Ring1][C][N][C][C][=C][Branch1][C][C][C][=C][Branch1][C][C][NH1][C][Ring1][Branch2][=O][=N][C][Branch2][Ring1][#Branch1][N][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][#C][=N][Ring2][Ring2][Branch2]
0
0
0
[ 2, 1357, 1488, 2378, 2051, 2512, 1373, 2052, 1408, 1317, 2661, 1568, 1339, 438, 1865, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
16
[C][C][C][N][Branch2][Branch1][=C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][N][C][=N][C][Branch2][Ring1][Ring1][N][C][=N][C][Branch1][=Branch1][C][Branch1][C][C][C][=C][Branch1][C][Br][S][Ring1][=Branch2][=N][C][Branch2][Ring1][Ring1][N][C][=N][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][Dy][=N][Ring2][Ring1][N][C][C][Branch1][C][C][O][Ring2][Ring2][=Branch2]
0
0
0
[ 2, 1715, 1948, 2712, 1359, 1296, 1277, 1440, 1323, 1751, 1361, 2444, 1325, 1339, 1527, 429, 2027, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
18
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][C][C][C][Branch2][Ring2][O][N][C][=N][C][Branch1][P][N][C][C][=C][C][=C][N][=C][Ring1][=Branch1][O][C][Branch1][C][F][F][=N][C][Branch1][=N][N][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][=N][Ring2][Ring1][#Branch2][C][=Branch1][C][=O][N][Dy]
0
0
0
[ 2, 2070, 1543, 1366, 2717, 1409, 1401, 1451, 1417, 1513, 3 ]
[ 0, 0, 0, 0, 0, 0, 0, 0, 0, 0, 0 ]
[ 1, 1, 1, 1, 1, 1, 1, 1, 1, 1, 1 ]
[ 0, 0, 0 ]
11