JRR
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C2 | C1 | sing | 1.53Å | 1.52Å | |
C1 | O1 | sing | 1.43Å | 1.43Å | |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C1 | H1A | sing | 1.09Å | 1.10Å | |
O1 | C3' | sing | 1.43Å | 1.44Å | |
C2 | N2 | sing | 1.47Å | 1.45Å | |
C2 | H2 | sing | 1.09Å | 1.10Å | |
C2 | H2A | sing | 1.09Å | 1.10Å | |
C3 | N2 | sing | 1.47Å | 1.45Å | |
N2 | HN2 | sing | 1.01Å | 1.00Å | |
C3 | C4 | sing | 1.53Å | 1.52Å | |
C3 | H3 | sing | 1.09Å | 1.10Å | |
C3 | H3A | sing | 1.09Å | 1.10Å | |
C11 | C4 | sing | 1.51Å | 1.51Å | |
C4 | H4 | sing | 1.09Å | 1.10Å | |
C4 | H4A | sing | 1.09Å | 1.10Å | |
C2' | N1' | sing | 1.49Å | 1.45Å | |
C5' | N1' | sing | 1.49Å | 1.47Å | |
N1' | HN1' | sing | 1.01Å | 1.00Å | |
C12 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
C11 | C16 | sing | 1.38Å | 1.41Å | Aromatic |
C13 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
C12 | H12 | sing | 1.08Å | 1.08Å | |
F13 | C13 | sing | 1.35Å | 1.35Å | |
C13 | C14 | doub | 1.38Å | 1.41Å | Aromatic |
C14 | C15 | sing | 1.38Å | 1.41Å | Aromatic |
C14 | H14 | sing | 1.08Å | 1.08Å | |
C15 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
C15 | H15 | sing | 1.08Å | 1.08Å | |
C16 | H16 | sing | 1.08Å | 1.08Å | |
C2A | N1A | doub | 1.32Å | 1.36Å | Aromatic |
N1A | C6A | sing | 1.32Å | 1.36Å | Aromatic |
C3' | C2' | sing | 1.54Å | 1.53Å | |
C2' | H2' | sing | 1.09Å | 1.10Å | |
C2' | H2'A | sing | 1.09Å | 1.10Å | |
C7A | C2A | sing | 1.51Å | 1.51Å | |
C2A | C3A | sing | 1.38Å | 1.40Å | Aromatic |
C3' | C4' | sing | 1.54Å | 1.53Å | |
C3' | H3' | sing | 1.09Å | 1.10Å | |
C3A | C4A | doub | 1.39Å | 1.39Å | Aromatic |
C3A | H3AA | sing | 1.08Å | 1.08Å | |
C7A | C4' | sing | 1.53Å | 1.53Å | |
C4' | C5' | sing | 1.54Å | 1.53Å | |
C4' | H4' | sing | 1.09Å | 1.10Å | |
C4A | C5A | sing | 1.38Å | 1.39Å | Aromatic |
C4A | C8A | sing | 1.51Å | 1.51Å | |
C5' | H5' | sing | 1.09Å | 1.10Å | |
C5' | H5'A | sing | 1.09Å | 1.10Å | |
C6A | C5A | doub | 1.39Å | 1.40Å | Aromatic |
C5A | H5A | sing | 1.08Å | 1.08Å | |
N6A | C6A | sing | 1.39Å | 1.36Å | |
N6A | HN6A | sing | 0.97Å | 1.00Å | |
N6A | HN6B | sing | 0.97Å | 1.00Å | |
C7A | H7A | sing | 1.09Å | 1.10Å | |
C7A | H7AA | sing | 1.09Å | 1.10Å | |
C8A | H8A | sing | 1.09Å | 1.10Å | |
C8A | H8AA | sing | 1.09Å | 1.10Å | |
C8A | H8AB | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2 | C1 | O1 | 109.4° | 109.5° |
C2 | C1 | H1 | 109.5° | 109.5° |
C2 | C1 | H1A | 109.5° | 109.5° |
C1 | C2 | N2 | 113.4° | 109.5° |
C1 | C2 | H2 | 108.2° | 109.5° |
C1 | C2 | H2A | 108.2° | 109.5° |
O1 | C1 | H1 | 109.5° | 109.5° |
O1 | C1 | H1A | 109.5° | 109.5° |
C1 | O1 | C3' | 113.6° | 114.0° |
H1 | C1 | H1A | 109.4° | 109.5° |
O1 | C3' | C2' | 110.5° | 110.3° |
O1 | C3' | C4' | 108.0° | 110.3° |
O1 | C3' | H3' | 108.2° | 110.3° |
N2 | C2 | H2 | 108.2° | 109.5° |
N2 | C2 | H2A | 108.2° | 109.5° |
C2 | N2 | C3 | 117.4° | 111.0° |
C2 | N2 | HN2 | 106.9° | 111.0° |
H2 | C2 | H2A | 110.7° | 109.4° |
C3 | N2 | HN2 | 106.9° | 111.0° |
N2 | C3 | C4 | 111.4° | 109.5° |
N2 | C3 | H3 | 108.9° | 109.5° |
N2 | C3 | H3A | 108.8° | 109.4° |
C4 | C3 | H3 | 108.8° | 109.5° |
C4 | C3 | H3A | 108.8° | 109.5° |
C3 | C4 | C11 | 110.2° | 109.5° |
C3 | C4 | H4 | 109.2° | 109.5° |
C3 | C4 | H4A | 109.2° | 109.4° |
H3 | C3 | H3A | 110.1° | 109.5° |
C11 | C4 | H4 | 109.2° | 109.4° |
C11 | C4 | H4A | 109.2° | 109.5° |
C4 | C11 | C12 | 118.6° | 120.0° |
C4 | C11 | C16 | 121.0° | 120.0° |
H4 | C4 | H4A | 109.7° | 109.5° |
C2' | N1' | C5' | 112.7° | 104.2° |
C2' | N1' | HN1' | 108.4° | 110.9° |
N1' | C2' | C3' | 103.6° | 104.6° |
N1' | C2' | H2' | 111.5° | 110.5° |
N1' | C2' | H2'A | 111.5° | 110.4° |
C5' | N1' | HN1' | 108.4° | 111.0° |
N1' | C5' | C4' | 104.0° | 104.6° |
N1' | C5' | H5' | 111.4° | 110.4° |
N1' | C5' | H5'A | 111.4° | 110.4° |
C12 | C11 | C16 | 120.4° | 120.1° |
C11 | C12 | C13 | 120.3° | 119.9° |
C11 | C12 | H12 | 119.9° | 120.0° |
C11 | C16 | C15 | 119.5° | 120.0° |
C11 | C16 | H16 | 120.3° | 120.0° |
C13 | C12 | H12 | 119.8° | 120.1° |
C12 | C13 | F13 | 118.3° | 120.0° |
C12 | C13 | C14 | 119.8° | 120.0° |
F13 | C13 | C14 | 121.9° | 120.0° |
C13 | C14 | C15 | 119.9° | 119.9° |
C13 | C14 | H14 | 120.0° | 120.0° |
C15 | C14 | H14 | 120.0° | 120.1° |
C14 | C15 | C16 | 120.1° | 120.1° |
C14 | C15 | H15 | 120.0° | 119.9° |
C16 | C15 | H15 | 120.0° | 120.0° |
C15 | C16 | H16 | 120.3° | 120.0° |
C2A | N1A | C6A | 121.7° | 121.6° |
N1A | C2A | C7A | 119.7° | 119.6° |
N1A | C2A | C3A | 120.3° | 120.9° |
N1A | C6A | C5A | 119.6° | 120.6° |
N1A | C6A | N6A | 120.3° | 119.7° |
C3' | C2' | H2' | 111.5° | 110.4° |
C3' | C2' | H2'A | 111.5° | 110.5° |
C2' | C3' | C4' | 104.1° | 105.1° |
C2' | C3' | H3' | 111.8° | 110.3° |
H2' | C2' | H2'A | 107.3° | 110.3° |
C7A | C2A | C3A | 120.0° | 119.5° |
C2A | C7A | C4' | 109.0° | 109.4° |
C2A | C7A | H7A | 109.6° | 109.5° |
C2A | C7A | H7AA | 109.6° | 109.5° |
C2A | C3A | C4A | 119.0° | 119.3° |
C2A | C3A | H3AA | 120.5° | 120.3° |
C4' | C3' | H3' | 114.2° | 110.5° |
C3' | C4' | C7A | 113.8° | 110.3° |
C3' | C4' | C5' | 104.1° | 105.0° |
C3' | C4' | H4' | 111.6° | 110.3° |
C4A | C3A | H3AA | 120.5° | 120.4° |
C3A | C4A | C5A | 119.9° | 118.6° |
C3A | C4A | C8A | 119.6° | 120.7° |
C7A | C4' | C5' | 113.1° | 110.4° |
C7A | C4' | H4' | 102.3° | 110.3° |
C4' | C7A | H7A | 109.6° | 109.5° |
C4' | C7A | H7AA | 109.6° | 109.4° |
C5' | C4' | H4' | 112.4° | 110.4° |
C4' | C5' | H5' | 111.3° | 110.4° |
C4' | C5' | H5'A | 111.4° | 110.4° |
C5A | C4A | C8A | 120.5° | 120.7° |
C4A | C5A | C6A | 119.5° | 119.1° |
C4A | C5A | H5A | 120.2° | 120.5° |
C4A | C8A | H8A | 109.5° | 109.5° |
C4A | C8A | H8AA | 109.5° | 109.5° |
C4A | C8A | H8AB | 109.4° | 109.5° |
H5' | C5' | H5'A | 107.5° | 110.4° |
C6A | C5A | H5A | 120.3° | 120.4° |
C5A | C6A | N6A | 120.2° | 119.7° |
C6A | N6A | HN6A | 109.5° | 120.0° |
C6A | N6A | HN6B | 109.5° | 120.0° |
HN6A | N6A | HN6B | 109.4° | 120.0° |
H7A | C7A | H7AA | 109.3° | 109.5° |
H8A | C8A | H8AA | 109.4° | 109.4° |
H8A | C8A | H8AB | 109.5° | 109.5° |
H8AA | C8A | H8AB | 109.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2 | C1 | O1 | H1 | 120.0° | 120.0° |
C2 | C1 | O1 | H1A | 120.0° | 120.0° |
C2 | C1 | H1 | H1A | 120.1° | 120.0° |
C2 | C1 | O1 | C3' | 177.1° | 180.0° |
C1 | C2 | N2 | H2 | 120.0° | 120.0° |
C1 | C2 | N2 | H2A | 120.0° | 120.0° |
C1 | C2 | H2 | H2A | 118.4° | 120.0° |
C1 | C2 | N2 | C3 | 148.0° | 180.0° |
C1 | C2 | N2 | HN2 | 92.0° | 56.0° |
O1 | C1 | H1 | H1A | 120.0° | 120.0° |
O1 | C1 | C2 | N2 | 61.9° | 65.0° |
O1 | C1 | C2 | H2 | 178.1° | 175.0° |
O1 | C1 | C2 | H2A | 58.1° | 55.0° |
C1 | O1 | C3' | C2' | 74.8° | 91.5° |
C1 | O1 | C3' | C4' | 171.9° | 152.9° |
C1 | O1 | C3' | H3' | 47.8° | 30.6° |
H1 | C1 | O1 | C3' | 57.1° | 60.0° |
H1 | C1 | C2 | N2 | 178.1° | 55.0° |
H1 | C1 | C2 | H2 | 58.1° | 65.0° |
H1 | C1 | C2 | H2A | 61.9° | 175.0° |
H1A | C1 | O1 | C3' | 62.9° | 60.0° |
H1A | C1 | C2 | N2 | 58.0° | 175.0° |
H1A | C1 | C2 | H2 | 62.0° | 55.0° |
H1A | C1 | C2 | H2A | 178.0° | 65.0° |
O1 | C3' | C2' | N1' | 85.3° | 142.8° |
O1 | C3' | C2' | C4' | 115.7° | 118.9° |
O1 | C3' | C2' | H3' | 120.6° | 122.1° |
O1 | C3' | C2' | H2' | 34.7° | 23.9° |
O1 | C3' | C2' | H2'A | 154.7° | 98.4° |
O1 | C3' | C4' | H3' | 120.4° | 122.2° |
O1 | C3' | C4' | C7A | 40.0° | 0.0° |
O1 | C3' | C4' | C5' | 83.4° | 118.9° |
O1 | C3' | C4' | H4' | 155.2° | 122.2° |
N2 | C2 | H2 | H2A | 118.4° | 120.0° |
C2 | N2 | C3 | HN2 | 120.0° | 124.0° |
C2 | N2 | C3 | C4 | 157.7° | 180.0° |
C2 | N2 | C3 | H3 | 82.3° | 59.9° |
C2 | N2 | C3 | H3A | 37.8° | 60.0° |
H2 | C2 | N2 | C3 | 28.0° | 60.0° |
H2 | C2 | N2 | HN2 | 148.0° | 176.0° |
H2A | C2 | N2 | C3 | 92.0° | 60.0° |
H2A | C2 | N2 | HN2 | 28.0° | 64.0° |
N2 | C3 | C4 | H3 | 120.0° | 120.0° |
N2 | C3 | C4 | H3A | 120.0° | 119.9° |
N2 | C3 | H3 | H3A | 119.2° | 119.9° |
N2 | C3 | C4 | C11 | 178.5° | 180.0° |
N2 | C3 | C4 | H4 | 58.5° | 60.0° |
N2 | C3 | C4 | H4A | 61.5° | 60.0° |
HN2 | N2 | C3 | C4 | 37.7° | 55.9° |
HN2 | N2 | C3 | H3 | 157.7° | 176.0° |
HN2 | N2 | C3 | H3A | 82.2° | 64.1° |
C4 | C3 | H3 | H3A | 119.2° | 120.1° |
C3 | C4 | C11 | H4 | 120.0° | 120.0° |
C3 | C4 | C11 | H4A | 120.0° | 120.0° |
C3 | C4 | H4 | H4A | 119.7° | 120.0° |
C3 | C4 | C11 | C12 | 101.5° | 89.7° |
C3 | C4 | C11 | C16 | 79.0° | 90.0° |
H3 | C3 | C4 | C11 | 61.5° | 60.0° |
H3 | C3 | C4 | H4 | 178.5° | 180.0° |
H3 | C3 | C4 | H4A | 58.5° | 60.0° |
H3A | C3 | C4 | C11 | 58.5° | 60.0° |
H3A | C3 | C4 | H4 | 61.5° | 60.0° |
H3A | C3 | C4 | H4A | 178.5° | 180.0° |
C11 | C4 | H4 | H4A | 119.7° | 120.0° |
C4 | C11 | C12 | C16 | 179.5° | 179.6° |
C4 | C11 | C12 | C13 | 179.8° | 180.0° |
C4 | C11 | C12 | H12 | 0.2° | 0.1° |
C4 | C11 | C16 | C15 | 179.9° | 179.8° |
C4 | C11 | C16 | H16 | 0.1° | 0.1° |
H4 | C4 | C11 | C12 | 18.5° | 150.3° |
H4 | C4 | C11 | C16 | 161.0° | 30.1° |
H4A | C4 | C11 | C12 | 138.5° | 30.3° |
H4A | C4 | C11 | C16 | 41.0° | 150.1° |
C2' | N1' | C5' | HN1' | 120.0° | 119.5° |
N1' | C2' | C3' | H2' | 120.0° | 118.8° |
N1' | C2' | C3' | H2'A | 120.0° | 118.9° |
N1' | C2' | H2' | H2'A | 122.4° | 122.3° |
N1' | C2' | C3' | C4' | 30.4° | 23.9° |
N1' | C2' | C3' | H3' | 154.1° | 95.2° |
C2' | N1' | C5' | C4' | 5.6° | 39.5° |
C2' | N1' | C5' | H5' | 125.6° | 158.3° |
C2' | N1' | C5' | H5'A | 114.4° | 79.3° |
C5' | N1' | C2' | C3' | 15.6° | 39.5° |
C5' | N1' | C2' | H2' | 135.6° | 79.3° |
C5' | N1' | C2' | H2'A | 104.4° | 158.4° |
N1' | C5' | C4' | C3' | 24.4° | 23.9° |
N1' | C5' | C4' | C7A | 148.4° | 142.8° |
N1' | C5' | C4' | H5' | 120.0° | 118.8° |
N1' | C5' | C4' | H5'A | 120.0° | 118.8° |
N1' | C5' | C4' | H4' | 96.4° | 95.0° |
N1' | C5' | H5' | H5'A | 122.2° | 122.4° |
HN1' | N1' | C2' | C3' | 135.6° | 80.0° |
HN1' | N1' | C2' | H2' | 104.4° | 161.1° |
HN1' | N1' | C2' | H2'A | 15.6° | 38.9° |
HN1' | N1' | C5' | C4' | 114.4° | 80.0° |
HN1' | N1' | C5' | H5' | 5.5° | 38.8° |
HN1' | N1' | C5' | H5'A | 125.5° | 161.2° |
C11 | C12 | C13 | H12 | 180.0° | 179.9° |
C11 | C12 | C13 | F13 | 179.8° | 180.0° |
C11 | C12 | C13 | C14 | 0.2° | 0.0° |
C12 | C11 | C16 | C15 | 0.4° | 0.6° |
C12 | C11 | C16 | H16 | 179.6° | 179.7° |
C16 | C11 | C12 | C13 | 0.3° | 0.3° |
C16 | C11 | C12 | H12 | 179.7° | 179.8° |
C11 | C16 | C15 | C14 | 0.4° | 0.6° |
C11 | C16 | C15 | H16 | 180.0° | 179.7° |
C11 | C16 | C15 | H15 | 179.7° | 179.7° |
C12 | C13 | F13 | C14 | 180.0° | 180.0° |
C12 | C13 | C14 | C15 | 0.2° | 0.0° |
C12 | C13 | C14 | H14 | 179.8° | 180.0° |
H12 | C12 | C13 | F13 | 0.2° | 0.0° |
H12 | C12 | C13 | C14 | 179.8° | 180.0° |
F13 | C13 | C14 | C15 | 179.8° | 180.0° |
F13 | C13 | C14 | H14 | 0.2° | 0.0° |
C13 | C14 | C15 | H14 | 180.0° | 180.0° |
C13 | C14 | C15 | C16 | 0.3° | 0.3° |
C13 | C14 | C15 | H15 | 179.7° | 180.0° |
C14 | C15 | C16 | H15 | 180.0° | 179.7° |
C14 | C15 | C16 | H16 | 179.6° | 179.7° |
H14 | C14 | C15 | C16 | 179.7° | 179.7° |
H14 | C14 | C15 | H15 | 0.3° | 0.0° |
H15 | C15 | C16 | H16 | 0.4° | 0.0° |
N1A | C2A | C7A | C3A | 178.5° | 180.0° |
N1A | C2A | C3A | C4A | 0.9° | 0.0° |
N1A | C2A | C3A | H3AA | 179.1° | 180.0° |
N1A | C2A | C7A | C4' | 104.4° | 55.0° |
C2A | N1A | C6A | C5A | 0.9° | 0.0° |
C2A | N1A | C6A | N6A | 179.1° | 180.0° |
N1A | C2A | C7A | H7A | 135.6° | 65.0° |
N1A | C2A | C7A | H7AA | 15.6° | 175.0° |
C6A | N1A | C2A | C7A | 179.5° | 180.0° |
C6A | N1A | C2A | C3A | 0.9° | 0.0° |
N1A | C6A | C5A | C4A | 0.9° | 0.0° |
N1A | C6A | C5A | N6A | 180.0° | 180.0° |
N1A | C6A | C5A | H5A | 179.1° | 179.9° |
N1A | C6A | N6A | HN6A | 0.0° | 0.0° |
N1A | C6A | N6A | HN6B | 120.0° | 180.0° |
C3' | C2' | H2' | H2'A | 122.4° | 122.4° |
C2' | C3' | C4' | H3' | 122.2° | 119.0° |
C2' | C3' | C4' | C7A | 157.5° | 118.9° |
C2' | C3' | C4' | C5' | 34.1° | 0.0° |
C2' | C3' | C4' | H4' | 87.3° | 118.9° |
H2' | C2' | C3' | C4' | 150.4° | 95.0° |
H2' | C2' | C3' | H3' | 85.9° | 146.0° |
H2'A | C2' | C3' | C4' | 89.6° | 142.7° |
H2'A | C2' | C3' | H3' | 34.1° | 23.7° |
C2A | C7A | C4' | C3' | 178.5° | 175.0° |
C7A | C2A | C3A | C4A | 179.4° | 180.0° |
C7A | C2A | C3A | H3AA | 0.6° | 0.1° |
C2A | C7A | C4' | H7A | 120.0° | 120.0° |
C2A | C7A | C4' | H7AA | 120.0° | 120.0° |
C2A | C7A | C4' | C5' | 63.1° | 69.4° |
C2A | C7A | C4' | H4' | 58.0° | 52.9° |
C2A | C7A | H7A | H7AA | 120.2° | 120.0° |
C2A | C3A | C4A | H3AA | 180.0° | 180.0° |
C3A | C2A | C7A | C4' | 74.1° | 125.0° |
C2A | C3A | C4A | C5A | 0.8° | 0.0° |
C2A | C3A | C4A | C8A | 179.5° | 180.0° |
C3A | C2A | C7A | H7A | 45.9° | 115.0° |
C3A | C2A | C7A | H7AA | 165.9° | 5.0° |
C3' | C4' | C7A | C5' | 118.4° | 115.6° |
C3' | C4' | C7A | H4' | 120.5° | 122.1° |
C3' | C4' | C5' | H4' | 120.9° | 118.9° |
C3' | C4' | C5' | H5' | 144.4° | 142.6° |
C3' | C4' | C5' | H5'A | 95.6° | 95.0° |
C3' | C4' | C7A | H7A | 58.5° | 55.0° |
C3' | C4' | C7A | H7AA | 61.5° | 65.0° |
H3' | C3' | C4' | C7A | 80.3° | 122.1° |
H3' | C3' | C4' | C5' | 156.2° | 118.9° |
H3' | C3' | C4' | H4' | 34.8° | 0.0° |
C3A | C4A | C5A | C8A | 179.7° | 180.0° |
C3A | C4A | C5A | C6A | 0.8° | 0.0° |
C3A | C4A | C5A | H5A | 179.2° | 179.9° |
C3A | C4A | C8A | H8A | 89.9° | 90.0° |
C3A | C4A | C8A | H8AA | 150.2° | 150.0° |
C3A | C4A | C8A | H8AB | 30.2° | 30.1° |
H3AA | C3A | C4A | C5A | 179.2° | 180.0° |
H3AA | C3A | C4A | C8A | 0.5° | 0.0° |
C7A | C4' | C5' | H4' | 115.2° | 122.2° |
C7A | C4' | C5' | H5' | 91.6° | 98.5° |
C7A | C4' | C5' | H5'A | 28.4° | 23.9° |
C4' | C7A | H7A | H7AA | 120.2° | 120.0° |
C4' | C5' | H5' | H5'A | 122.2° | 122.4° |
C5' | C4' | C7A | H7A | 176.9° | 170.6° |
C5' | C4' | C7A | H7AA | 56.9° | 50.6° |
H4' | C4' | C5' | H5' | 23.6° | 23.8° |
H4' | C4' | C5' | H5'A | 143.6° | 146.2° |
H4' | C4' | C7A | H7A | 62.0° | 67.1° |
H4' | C4' | C7A | H7AA | 178.0° | 172.8° |
C4A | C5A | C6A | H5A | 180.0° | 179.9° |
C4A | C5A | C6A | N6A | 179.1° | 180.0° |
C5A | C4A | C8A | H8A | 89.8° | 90.0° |
C5A | C4A | C8A | H8AA | 30.1° | 30.0° |
C5A | C4A | C8A | H8AB | 150.2° | 149.9° |
C8A | C4A | C5A | C6A | 179.5° | 180.0° |
C8A | C4A | C5A | H5A | 0.5° | 0.1° |
C4A | C8A | H8A | H8AA | 120.0° | 120.0° |
C4A | C8A | H8A | H8AB | 120.0° | 120.1° |
C4A | C8A | H8AA | H8AB | 120.0° | 120.0° |
C5A | C6A | N6A | HN6A | 180.0° | 180.0° |
C5A | C6A | N6A | HN6B | 60.0° | 0.0° |
H5A | C5A | C6A | N6A | 0.9° | 0.1° |
C6A | N6A | HN6A | HN6B | 120.0° | 180.0° |
H8A | C8A | H8AA | H8AB | 120.0° | 119.9° |