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Azide list | Nitro list | AmidineGuanidine1 list | AmidineGuanidine2 list | Sulfate list | Sulfonate list | Sulfinic_acid list | Phenyl_carboxyl list | Carboxyl list | Thioic_acid list | Phenyl_Thiol list | Thiol list | Phosphate list | Phosphonate list | Phenol list | Peroxide1 list | Peroxide2 list | O=C-C=C-OH list | Vinyl_alcohol list | Alcohol list | N-hydroxyamide list | Ringed_imide1 list | Ringed_imide2 list | Imide list | Imide2 list | Amide_electronegative list | Amide list | Sulfonamide list | Anilines_primary list | Anilines_secondary list | Anilines_tertiary list | Aromatic_nitrogen_unprotonated list | Amines_primary_secondary_tertiary list | Phosphinic_acid list | Phosphate_diester list | Phosphonate_ester list | primary_hydroxyl_amine_2 list | Indole_pyrrole list | Aromatic_nitrogen_protonated list |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
[
4.6,
4.7
] | [
-1000
] | [
13.6,
10.1,
13.4,
10.4,
11.7,
13.6,
11.5,
13.7,
11.8,
12.1,
13.6,
13.4,
8.3,
10.9,
12.3
] | [
11.1,
10.3,
8.3,
11.1,
10.9,
9.2,
8.9,
7.7,
6.7,
8.3,
6.8,
10.7,
4.8,
8.1,
9.2,
8.5,
8.1,
9.1,
8,
9,
9.7,
9.3,
9.3,
8.6,
8.1,
9.5,
10.3,
9.8,
8.6,
8.3,
7.9,
9.1,
8.4,
9.2,
8.5,
9.4,
4.7,
8.3,
10.7,
12.4,
12.3,
12.5,
11.6,
14.4,
... | [
-1.5,
-1.4,
-1.7,
-1.4,
-1.2,
-3.4,
-3.9,
-4.4
] | [
-1.9,
-1.7,
-5.9,
-2.8,
-0.8,
-0.6,
-2.5,
-1,
-1.3,
-1,
-0.6,
-1.8,
-1.8
] | [
1.9,
1.7,
2,
1.5,
2.2,
1,
2.3,
1.4,
2.2
] | [
3.7,
4.5,
3.7,
3,
3.8,
3.1,
4.5,
4.5,
4.3,
4.3,
3.6,
4.5,
4.5,
4.5,
1.9,
0.1,
3.6,
3.6,
4.5,
4.2,
2.8,
3.8,
4.2,
3.9,
4.2,
3.9,
4.3,
3.6,
3.9,
4.6,
3.8,
3.5,
3.4,
4.1,
-0.6,
3.3,
4,
2.9,
3.4,
3.7,
4,
4.2,
3.6,
-0.6,
4.3,
4.2,
... | [
4.2,
4.6,
4.6,
4.8,
5.8,
3.2,
2.7,
4.5,
4.7,
4.7,
4.2,
1.9,
3.2,
2.6,
3.6,
4.7,
5.1,
4.6,
4.6,
4.7,
3.2,
4.2,
4,
4.8,
3.2,
4.2,
3.8,
2.4,
3.8,
3.8,
3.8,
2.6,
3.7,
4.7,
4.8,
-0.7,
2.6,
2.5,
3.7,
3.4,
4.7,
4.9,
4.6,
-0.7,
4.7,
1... | [
-0.6,
1.7,
-0.6,
2.5,
-0.4,
-0.4,
2.6
] | [
5.3,
6.3,
-0.8,
6.4,
2.7,
2.8,
4.9,
-0.8,
5.5,
5.9,
7.2,
6.2,
7,
5.4,
5.5,
8.6,
6.6
] | [
7.7,
7.3,
7.7,
7.2,
7.6,
7.5,
9.4,
10.4,
10.2,
10.6,
10.3,
8.5,
10,
10.9,
8.6,
7.9,
11.1,
11.2,
7.9,
9.4,
7.3,
10.7,
9.3,
7.9,
9.5,
8.4,
9.9,
10.2,
10.2
] | [
[
2,
6.5
],
[
2,
6.5
],
[
2.3,
6.8
],
[
4.2,
9.7
],
[
4,
7.3
],
[
2.7,
6.7
],
[
1.3,
5.8
],
[
2,
6.8
],
[
2.9,
5.9
],
[
5.9,
6.2
],
[
1.6,
6.7
],
[
1,
5.8
],
[
2,
5... | [
[
1.1,
6.5
],
[
2.7,
8.4
],
[
2.8,
8.7
],
[
1.3,
6.5
],
[
2.7,
8.5
],
[
2.9,
9
],
[
2.6,
8.2
],
[
2.5,
8.2
],
[
2.1,
7.5
],
[
1.4,
6.7
],
[
1.3,
6.5
],
[
1.3,
6.7
],
[
... | [
3.9,
4.3,
5.2,
6,
7.6,
5.2,
6.3,
7.8,
4.7,
6.6,
10,
5,
10,
8.9,
0.1,
-0.7,
-0.8,
10.2,
-1.1,
-1,
6.3,
6.5,
6.4,
6.3,
10.3,
10.3,
7.2,
6.7,
-1,
8.3,
-1,
8.1,
8.4,
-1,
7.1,
6.1,
8.3,
8.7,
-1,
10.1,
9.6,
7.7,
8,
6.9,
8.3,
10.2,
... | [
7.1,
9.3,
9.8,
8.6,
9.6,
8.1,
9.6,
8.9,
8.2,
9,
9.4,
9,
8.7,
8.9,
7.8,
7.4,
9,
8.9
] | [
12.6,
11.5,
11.2,
11.2,
11.9,
10.6,
13.3,
11.4,
12.8,
11,
12.8,
12.8,
10.5,
12.5,
12.6,
12.4,
12.6
] | [
4.2,
3.6,
3.6,
3.6,
3.1,
3.6,
1.7,
4,
3.5,
3.6,
3.6,
2.4,
3.2,
5.2,
4.3
] | [
9.2,
9.5,
9.5,
9.6,
9.5,
3.9,
8.5,
10.7,
10.4,
8.6,
9.5,
10.5,
9.3,
9.2,
9.1,
9.4,
10.5,
9.4,
7.4,
5.7,
6.8
] | [
14.6,
15.4,
15.5,
15.6,
15.7,
15.1,
15.1,
13.3,
14.3,
12.4,
14.9,
15.5,
9.2,
12.2,
15.4,
12.1,
12.2,
16,
17,
14.4,
13.3,
24,
14,
15.1,
16.8,
15.2
] | [
8,
9,
8.3,
11.1,
10.8,
8.4,
8.8,
10.5,
8.5,
10.1,
8.7,
8.2,
9.8,
10.8,
8.1,
11.2,
11.1,
8.2,
9.9,
7.7,
8.3
] | [
6.1,
6.9,
7.5,
5.8,
6.2,
6.4,
6,
6.6
] | [
9.3,
9.5,
9.6,
11.4,
10.5,
10.2,
10,
4.4,
9.8,
8.7,
9.4,
8.8,
7.7,
6.2,
10.5,
11.2,
9.4,
9.4,
7.7,
6.2,
8.7,
8.3,
6.3,
5.2
] | [
1.2,
2.1,
4.1
] | [
9.8,
10.3,
9.1,
9.4,
11,
10.3,
12.9,
10.2,
10.3,
9.1
] | [
-0.6,
-0.7,
6.8,
6.8,
9.3,
1.7,
1.9,
2.1,
2.4,
8.9,
1.5,
2,
2.1,
2.2,
-0.8,
5,
4.2,
3.8,
1.6,
5.9,
2.9,
4,
4.7,
4.9,
4.5
] | [
10.4,
3.4,
10,
13.5,
8.2,
11.7,
3.5,
9.3,
9.6,
13.4,
13.4,
13.3,
18.5,
18.5,
15.1,
19.4,
10.4,
14.5
] | [
5,
7.8,
10.7,
8.5,
3.8,
7.6,
8.9,
9.7,
11.5,
8,
9.4,
10.8,
8.6,
8.3,
9.6,
9.6,
8.5,
9.5,
7.5,
7.9,
9.2,
8.9,
9,
6.5,
6.5,
6.3,
6.8,
3.9,
2.8,
4.9,
3.5,
9,
8.2,
9.3,
7.5,
6.8,
7.5,
10.3,
7.2,
7.7,
8.8,
8.2,
9.4,
10.3,
8.2,
6.2
... | [
3.5,
3.6,
0.3,
9.2,
2.3,
2.3,
5,
4.4,
4.3,
2.5,
4.4,
2.2,
3.1,
5.3,
4.2,
4.4,
5.2,
4.4,
9.2,
2.4,
3.5,
3.7,
4.1,
4.5,
4.4,
4.7,
4.8,
4.4,
4.3,
4.9,
4.9,
4.6,
5.1,
3,
4.7,
3.9,
4.4,
2,
3.4,
-0.4,
2.6,
10.6,
1.2,
0.9,
2.4,
5,
... | [
7.2,
4.2,
4.4,
7,
6.8,
6.3,
1.2,
4.1,
4.6,
5.1,
5.2,
5.1,
5.1,
5.4,
4.9,
4.6,
3.3,
5,
4.2,
2.5,
3.7,
4,
6.1,
5.4,
5.9,
4.9,
3.7,
4.6,
8.6,
4.6,
4.6,
3.3,
5,
4.3,
2.5,
3.7,
4,
7.3,
6.5,
-0.8,
0.3,
0.8,
4.5,
-0.9,
7.2,
7.2,
0.... | [
4.1,
3.9,
3.6,
4,
4.1,
2.1,
3.3,
4.9,
6.4,
5.7,
6.1,
8,
7.2,
6.6,
0.7,
1.4,
7.2,
4.8,
4.1,
2.6,
2.6,
2.6,
2.2,
7.5,
5.4,
4.4,
5.8,
4.2,
2.7,
2.4,
2.2,
2.1,
1.9,
4.6,
3.3,
5.1,
6,
2.6,
8.8,
5.5,
4.8,
4.1,
5.8,
4,
5.6,
4.1,
2.... | [
0.9,
2.9,
-0.4,
2.8,
4,
5,
5,
3.7,
4.9,
5.7,
4.9,
4.9,
5.6,
2.3,
3.3,
3.7,
2.6,
5,
5.7,
5.8,
5.8,
5.7,
6.7,
6,
6,
2.7,
5.5,
6,
5.3,
4.3,
3.2,
4.8,
6,
5.6,
6,
8.4,
9,
8.2,
3.8,
1.8,
3.3,
3.4,
3.5,
3.4,
3,
4.1,
1.8,
5,
0.9... | [
5,
5.5,
8.5,
10.8,
7,
11,
10.8,
11.3,
11.1,
9.7,
9,
9.6,
11.3,
9.5,
6.3,
7.9,
-1.1,
9.1,
10.2,
9.8,
9.1,
5.2,
9.4,
7.1,
7.9,
9.8,
8.1,
7.8,
8.7,
8.3,
7.4,
6.9,
9.7,
7,
9.3,
9.6,
8.7,
9.3,
9.9,
10.3,
7.9,
7.5,
8.6,
10.6,
8.9,
7... | [
3.3,
3.3,
4.2,
3.6,
3.2,
3.2,
3.2,
3.3,
3.2,
2.4,
2.7,
0.8,
3.1,
3.5,
2,
3.1,
2.5,
2.7,
3.1,
3
] | [
1.1,
1,
1.1,
1.2,
1.1,
1,
1.1,
0.9,
0.7,
0.5,
3.6,
3.9,
3.6,
1.6,
2.9,
4.2,
3.5,
12.7,
3.8,
4.1,
3.5,
3.4,
2.4
] | [
2,
2.2,
2,
1.9,
1.9,
1.9,
1.9,
2,
1.8,
2,
1.7,
1.7,
3.7,
2.1,
2.2,
2.3,
2.2,
2.1,
2.2,
2.2,
2.2,
2.4,
2.3,
2.3,
0.9
] | [
4.1,
4.6,
4.4,
4.2,
4.4,
4.3,
2.1
] | [
14.9,
15.3,
14.5,
0.1,
17.5,
17,
16.5,
16.6,
16.3,
16.3,
15.2,
15.4,
13,
12.5,
15.2,
16.1
] | [
7.7,
3,
11.1,
9.4,
8.3,
2.9,
8.7,
6.3
] |
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