USF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N23 | C22 | doub | 1.32Å | 1.32Å | Aromatic |
| N23 | C24 | sing | 1.33Å | 1.34Å | Aromatic |
| O25 | C24 | sing | 1.36Å | 1.36Å | |
| O25 | C26 | sing | 1.43Å | 1.44Å | |
| C22 | C21 | sing | 1.39Å | 1.40Å | Aromatic |
| C24 | C29 | doub | 1.39Å | 1.40Å | Aromatic |
| C26 | C27 | sing | 1.53Å | 1.55Å | |
| F33 | C32 | sing | 1.35Å | 1.35Å | |
| C21 | C20 | sing | 1.48Å | 1.48Å | |
| C21 | C30 | doub | 1.40Å | 1.41Å | Aromatic |
| C29 | C30 | sing | 1.39Å | 1.40Å | Aromatic |
| C29 | N28 | sing | 1.40Å | 1.41Å | |
| C27 | N28 | sing | 1.47Å | 1.48Å | |
| C32 | C20 | doub | 1.40Å | 1.40Å | Aromatic |
| C32 | C34 | sing | 1.38Å | 1.36Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C30 | C31 | sing | 1.51Å | 1.51Å | |
| N38 | C34 | sing | 1.39Å | 1.40Å | |
| C34 | C35 | doub | 1.41Å | 1.40Å | Aromatic |
| C19 | C18 | doub | 1.40Å | 1.40Å | Aromatic |
| C35 | C18 | sing | 1.42Å | 1.43Å | Aromatic |
| C35 | C36 | sing | 1.40Å | 1.40Å | Aromatic |
| C18 | C17 | sing | 1.41Å | 1.40Å | Aromatic |
| C36 | N37 | doub | 1.31Å | 1.30Å | Aromatic |
| C17 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| O14 | C13 | doub | 1.21Å | 1.22Å | |
| N37 | C16 | sing | 1.33Å | 1.33Å | Aromatic |
| C16 | N15 | sing | 1.39Å | 1.39Å | |
| C13 | C12 | sing | 1.50Å | 1.49Å | |
| C13 | N4 | sing | 1.30Å | 1.31Å | |
| C3 | C2 | sing | 1.53Å | 1.54Å | |
| N10 | C9 | doub | 1.32Å | 1.30Å | Aromatic |
| N10 | N11 | sing | 1.40Å | 1.39Å | Aromatic |
| N15 | C9 | sing | 1.40Å | 1.39Å | |
| C2 | N4 | sing | 1.47Å | 1.50Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C12 | N11 | sing | 1.47Å | 1.48Å | |
| C9 | C8 | sing | 1.41Å | 1.40Å | Aromatic |
| N11 | C7 | sing | 1.32Å | 1.34Å | Aromatic |
| N4 | C5 | sing | 1.45Å | 1.46Å | |
| C8 | C7 | doub | 1.36Å | 1.35Å | Aromatic |
| C7 | C6 | sing | 1.51Å | 1.52Å | |
| C6 | C5 | sing | 1.53Å | 1.54Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C19 | H11 | sing | 1.08Å | 1.08Å | |
| C22 | H12 | sing | 1.08Å | 1.08Å | |
| C27 | H13 | sing | 1.09Å | 1.10Å | |
| C27 | H14 | sing | 1.09Å | 1.10Å | |
| C31 | H15 | sing | 1.09Å | 1.10Å | |
| C31 | H16 | sing | 1.09Å | 1.10Å | |
| C31 | H17 | sing | 1.09Å | 1.10Å | |
| C5 | H18 | sing | 1.09Å | 1.10Å | |
| C5 | H19 | sing | 1.09Å | 1.10Å | |
| C6 | H20 | sing | 1.09Å | 1.10Å | |
| C6 | H21 | sing | 1.09Å | 1.10Å | |
| N15 | H22 | sing | 0.97Å | 1.00Å | |
| C17 | H23 | sing | 1.08Å | 1.08Å | |
| C26 | H24 | sing | 1.09Å | 1.10Å | |
| C26 | H25 | sing | 1.09Å | 1.10Å | |
| N28 | H26 | sing | 1.01Å | 1.00Å | |
| C36 | H27 | sing | 1.08Å | 1.08Å | |
| N38 | H28 | sing | 0.97Å | 1.00Å | |
| N38 | H29 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C22 | N23 | C24 | 121.0° | 122.2° |
| N23 | C22 | C21 | 120.8° | 120.7° |
| N23 | C22 | H12 | 119.6° | 119.6° |
| N23 | C24 | O25 | 121.4° | 118.5° |
| N23 | C24 | C29 | 122.1° | 120.5° |
| C24 | O25 | C26 | 116.9° | 116.7° |
| O25 | C24 | C29 | 116.5° | 121.1° |
| O25 | C26 | C27 | 111.8° | 108.0° |
| O25 | C26 | H24 | 108.9° | 109.8° |
| O25 | C26 | H25 | 108.9° | 109.8° |
| C22 | C21 | C20 | 119.4° | 120.5° |
| C22 | C21 | C30 | 119.8° | 118.9° |
| C21 | C22 | H12 | 119.6° | 119.6° |
| C24 | C29 | C30 | 118.6° | 119.1° |
| C24 | C29 | N28 | 118.5° | 122.1° |
| C26 | C27 | N28 | 113.4° | 108.5° |
| C26 | C27 | H13 | 108.5° | 109.6° |
| C26 | C27 | H14 | 108.5° | 109.8° |
| C27 | C26 | H24 | 108.9° | 109.8° |
| C27 | C26 | H25 | 108.9° | 109.7° |
| F33 | C32 | C20 | 118.3° | 119.6° |
| F33 | C32 | C34 | 120.2° | 119.7° |
| C20 | C21 | C30 | 120.6° | 120.5° |
| C21 | C20 | C32 | 117.1° | 119.7° |
| C21 | C20 | C19 | 122.3° | 119.7° |
| C21 | C30 | C29 | 117.6° | 118.5° |
| C21 | C30 | C31 | 121.6° | 120.7° |
| C30 | C29 | N28 | 122.8° | 118.8° |
| C29 | C30 | C31 | 120.8° | 120.8° |
| C29 | N28 | C27 | 111.5° | 112.1° |
| C29 | N28 | H26 | 109.0° | 111.0° |
| N28 | C27 | H13 | 108.5° | 109.6° |
| N28 | C27 | H14 | 108.5° | 109.6° |
| C27 | N28 | H26 | 109.0° | 111.0° |
| C20 | C32 | C34 | 121.5° | 120.7° |
| C32 | C20 | C19 | 120.6° | 120.6° |
| C32 | C34 | N38 | 120.3° | 120.2° |
| C32 | C34 | C35 | 119.6° | 119.6° |
| C20 | C19 | C18 | 118.9° | 119.7° |
| C20 | C19 | H11 | 120.5° | 120.1° |
| C30 | C31 | H15 | 109.5° | 109.4° |
| C30 | C31 | H16 | 109.4° | 109.5° |
| C30 | C31 | H17 | 109.4° | 109.5° |
| N38 | C34 | C35 | 120.2° | 120.3° |
| C34 | N38 | H28 | 109.5° | 120.1° |
| C34 | N38 | H29 | 109.5° | 120.0° |
| C34 | C35 | C18 | 119.7° | 119.6° |
| C34 | C35 | C36 | 120.7° | 121.6° |
| C19 | C18 | C35 | 119.8° | 119.8° |
| C19 | C18 | C17 | 122.1° | 121.9° |
| C18 | C19 | H11 | 120.6° | 120.2° |
| C18 | C35 | C36 | 119.7° | 118.8° |
| C35 | C18 | C17 | 118.1° | 118.3° |
| C35 | C36 | N37 | 119.7° | 120.2° |
| C35 | C36 | H27 | 120.2° | 119.9° |
| C18 | C17 | C16 | 117.5° | 118.6° |
| C18 | C17 | H23 | 121.2° | 120.7° |
| C36 | N37 | C16 | 122.7° | 122.7° |
| N37 | C36 | H27 | 120.1° | 119.9° |
| C17 | C16 | N37 | 122.3° | 121.4° |
| C17 | C16 | N15 | 121.5° | 119.3° |
| C16 | C17 | H23 | 121.3° | 120.7° |
| O14 | C13 | C12 | 114.8° | 116.8° |
| O14 | C13 | N4 | 124.1° | 116.7° |
| N37 | C16 | N15 | 116.2° | 119.3° |
| C16 | N15 | C9 | 124.2° | 120.0° |
| C16 | N15 | H22 | 117.9° | 120.0° |
| C12 | C13 | N4 | 121.1° | 126.4° |
| C13 | C12 | N11 | 111.8° | 109.4° |
| C13 | C12 | H9 | 108.9° | 109.5° |
| C13 | C12 | H10 | 108.9° | 109.5° |
| C13 | N4 | C2 | 116.4° | 110.9° |
| C13 | N4 | C5 | 130.4° | 138.2° |
| C3 | C2 | N4 | 114.7° | 109.4° |
| C3 | C2 | C1 | 110.7° | 109.5° |
| C3 | C2 | H4 | 105.3° | 109.5° |
| C2 | C3 | H5 | 109.5° | 109.5° |
| C2 | C3 | H6 | 109.5° | 109.4° |
| C2 | C3 | H7 | 109.5° | 109.5° |
| C9 | N10 | N11 | 107.7° | 107.3° |
| N10 | C9 | N15 | 127.3° | 126.0° |
| N10 | C9 | C8 | 108.2° | 108.0° |
| N10 | N11 | C12 | 123.3° | 127.7° |
| N10 | N11 | C7 | 109.1° | 109.5° |
| N15 | C9 | C8 | 124.5° | 126.0° |
| C9 | N15 | H22 | 117.9° | 120.0° |
| N4 | C2 | C1 | 114.2° | 109.5° |
| C2 | N4 | C5 | 113.2° | 110.9° |
| N4 | C2 | H4 | 105.7° | 109.4° |
| C2 | C1 | H1 | 109.5° | 109.4° |
| C2 | C1 | H2 | 109.5° | 109.4° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| C1 | C2 | H4 | 105.3° | 109.5° |
| C12 | N11 | C7 | 127.6° | 122.8° |
| N11 | C12 | H9 | 108.9° | 109.5° |
| N11 | C12 | H10 | 108.9° | 109.4° |
| C9 | C8 | C7 | 108.1° | 107.5° |
| C9 | C8 | H8 | 125.9° | 126.3° |
| N11 | C7 | C8 | 106.8° | 107.7° |
| N11 | C7 | C6 | 132.4° | 126.8° |
| N4 | C5 | C6 | 114.0° | 111.5° |
| N4 | C5 | H18 | 108.3° | 109.1° |
| N4 | C5 | H19 | 108.3° | 109.1° |
| C8 | C7 | C6 | 120.7° | 125.5° |
| C7 | C8 | H8 | 126.0° | 126.2° |
| C7 | C6 | C5 | 116.0° | 109.2° |
| C7 | C6 | H20 | 107.8° | 109.5° |
| C7 | C6 | H21 | 107.8° | 109.5° |
| C6 | C5 | H18 | 108.3° | 109.0° |
| C6 | C5 | H19 | 108.3° | 109.0° |
| C5 | C6 | H20 | 107.8° | 109.5° |
| C5 | C6 | H21 | 107.8° | 109.5° |
| H1 | C1 | H2 | 109.4° | 109.5° |
| H1 | C1 | H3 | 109.4° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.5° |
| H5 | C3 | H6 | 109.5° | 109.4° |
| H5 | C3 | H7 | 109.5° | 109.5° |
| H6 | C3 | H7 | 109.4° | 109.4° |
| H9 | C12 | H10 | 109.5° | 109.4° |
| H13 | C27 | H14 | 109.5° | 109.7° |
| H15 | C31 | H16 | 109.5° | 109.4° |
| H15 | C31 | H17 | 109.5° | 109.5° |
| H16 | C31 | H17 | 109.5° | 109.5° |
| H18 | C5 | H19 | 109.5° | 109.0° |
| H20 | C6 | H21 | 109.4° | 109.6° |
| H24 | C26 | H25 | 109.5° | 109.8° |
| H28 | N38 | H29 | 109.5° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C22 | N23 | C24 | O25 | 179.8° | 179.4° |
| N23 | C22 | C21 | H12 | 180.0° | 179.9° |
| C22 | N23 | C24 | C29 | 1.5° | 0.3° |
| N23 | C22 | C21 | C20 | 179.8° | 179.9° |
| N23 | C22 | C21 | C30 | 5.4° | 0.4° |
| N23 | C24 | O25 | C29 | 178.4° | 179.7° |
| N23 | C24 | O25 | C26 | 133.5° | 164.8° |
| C24 | N23 | C22 | C21 | 4.6° | 0.0° |
| N23 | C24 | C29 | C30 | 0.7° | 0.0° |
| N23 | C24 | C29 | N28 | 178.8° | 179.4° |
| C24 | N23 | C22 | H12 | 175.4° | 179.9° |
| C24 | O25 | C26 | C27 | 40.8° | 45.7° |
| O25 | C24 | C29 | C30 | 177.6° | 179.7° |
| O25 | C24 | C29 | N28 | 0.5° | 0.9° |
| C24 | O25 | C26 | H24 | 161.2° | 73.9° |
| C24 | O25 | C26 | H25 | 79.5° | 165.3° |
| C26 | O25 | C24 | C29 | 44.9° | 15.5° |
| O25 | C26 | C27 | H24 | 120.4° | 119.7° |
| O25 | C26 | C27 | H25 | 120.3° | 119.6° |
| O25 | C26 | C27 | N28 | 4.2° | 63.3° |
| O25 | C26 | C27 | H13 | 124.8° | 56.4° |
| O25 | C26 | C27 | H14 | 116.4° | 176.9° |
| O25 | C26 | H24 | H25 | 118.9° | 120.7° |
| C22 | C21 | C20 | C30 | 174.4° | 179.7° |
| C22 | C21 | C30 | C29 | 3.0° | 0.6° |
| C22 | C21 | C20 | C32 | 74.7° | 114.6° |
| C22 | C21 | C20 | C19 | 102.7° | 65.3° |
| C22 | C21 | C30 | C31 | 176.9° | 179.7° |
| C24 | C29 | C30 | C21 | 0.1° | 0.4° |
| C24 | C29 | C30 | N28 | 178.0° | 179.4° |
| C24 | C29 | N28 | C27 | 44.6° | 20.1° |
| C24 | C29 | C30 | C31 | 179.8° | 179.9° |
| C24 | C29 | N28 | H26 | 164.9° | 104.6° |
| C26 | C27 | N28 | C29 | 44.4° | 50.1° |
| C26 | C27 | N28 | H13 | 120.6° | 119.7° |
| C26 | C27 | N28 | H14 | 120.6° | 119.9° |
| C26 | C27 | H13 | H14 | 118.2° | 120.6° |
| C27 | C26 | H24 | H25 | 118.9° | 120.7° |
| C26 | C27 | N28 | H26 | 164.7° | 74.7° |
| F33 | C32 | C20 | C21 | 1.1° | 0.1° |
| F33 | C32 | C20 | C34 | 179.4° | 179.9° |
| F33 | C32 | C20 | C19 | 178.4° | 180.0° |
| F33 | C32 | C34 | N38 | 1.1° | 0.1° |
| F33 | C32 | C34 | C35 | 179.0° | 180.0° |
| C20 | C21 | C30 | C29 | 177.4° | 179.7° |
| C21 | C20 | C32 | C19 | 177.4° | 179.9° |
| C21 | C20 | C32 | C34 | 179.5° | 180.0° |
| C20 | C21 | C30 | C31 | 2.5° | 0.0° |
| C21 | C20 | C19 | C18 | 179.4° | 180.0° |
| C21 | C20 | C19 | H11 | 0.6° | 0.0° |
| C20 | C21 | C22 | H12 | 0.2° | 0.0° |
| C21 | C30 | C29 | C31 | 179.9° | 179.7° |
| C21 | C30 | C29 | N28 | 177.9° | 179.9° |
| C30 | C21 | C20 | C32 | 99.7° | 65.0° |
| C30 | C21 | C20 | C19 | 82.9° | 115.0° |
| C30 | C21 | C22 | H12 | 174.6° | 179.7° |
| C21 | C30 | C31 | H15 | 90.0° | 90.0° |
| C21 | C30 | C31 | H16 | 150.0° | 150.0° |
| C21 | C30 | C31 | H17 | 30.0° | 30.0° |
| C30 | C29 | N28 | C27 | 133.3° | 160.4° |
| C29 | C30 | C31 | H15 | 90.0° | 89.7° |
| C29 | C30 | C31 | H16 | 30.1° | 30.3° |
| C29 | C30 | C31 | H17 | 150.0° | 150.3° |
| C30 | C29 | N28 | H26 | 13.0° | 74.8° |
| C29 | N28 | C27 | H26 | 120.3° | 124.8° |
| N28 | C29 | C30 | C31 | 2.2° | 0.5° |
| C29 | N28 | C27 | H13 | 165.0° | 69.6° |
| C29 | N28 | C27 | H14 | 76.2° | 170.0° |
| N28 | C27 | H13 | H14 | 118.2° | 120.4° |
| N28 | C27 | C26 | H24 | 116.1° | 56.4° |
| N28 | C27 | C26 | H25 | 124.6° | 177.1° |
| C20 | C32 | C34 | N38 | 179.5° | 180.0° |
| C20 | C32 | C34 | C35 | 0.4° | 0.1° |
| C32 | C20 | C19 | C18 | 3.4° | 0.0° |
| C32 | C20 | C19 | H11 | 176.6° | 180.0° |
| C34 | C32 | C20 | C19 | 2.2° | 0.1° |
| C32 | C34 | N38 | C35 | 179.9° | 180.0° |
| C32 | C34 | C35 | C18 | 1.6° | 0.0° |
| C32 | C34 | C35 | C36 | 178.5° | 179.7° |
| C32 | C34 | N38 | H28 | 180.0° | 0.0° |
| C32 | C34 | N38 | H29 | 60.0° | 179.9° |
| C20 | C19 | C18 | H11 | 180.0° | 180.0° |
| C20 | C19 | C18 | C35 | 2.2° | 0.0° |
| C20 | C19 | C18 | C17 | 177.9° | 180.0° |
| C30 | C31 | H15 | H16 | 120.0° | 120.0° |
| C30 | C31 | H15 | H17 | 120.0° | 120.0° |
| C30 | C31 | H16 | H17 | 120.0° | 120.0° |
| N38 | C34 | C35 | C18 | 178.3° | 180.0° |
| N38 | C34 | C35 | C36 | 1.6° | 0.3° |
| C34 | N38 | H28 | H29 | 120.0° | 180.0° |
| C34 | C35 | C18 | C19 | 0.3° | 0.0° |
| C34 | C35 | C18 | C36 | 180.0° | 179.7° |
| C34 | C35 | C18 | C17 | 179.6° | 180.0° |
| C34 | C35 | C36 | N37 | 179.3° | 180.0° |
| C34 | C35 | C36 | H27 | 0.7° | 0.0° |
| C35 | C34 | N38 | H28 | 0.1° | 180.0° |
| C35 | C34 | N38 | H29 | 119.9° | 0.0° |
| C19 | C18 | C35 | C17 | 179.9° | 180.0° |
| C19 | C18 | C35 | C36 | 179.8° | 179.7° |
| C19 | C18 | C17 | C16 | 178.8° | 180.0° |
| C19 | C18 | C17 | H23 | 1.2° | 0.0° |
| C18 | C35 | C36 | N37 | 0.7° | 0.3° |
| C35 | C18 | C17 | C16 | 1.3° | 0.1° |
| C35 | C18 | C19 | H11 | 177.8° | 180.0° |
| C35 | C18 | C17 | H23 | 178.7° | 180.0° |
| C18 | C35 | C36 | H27 | 179.3° | 179.7° |
| C36 | C35 | C18 | C17 | 0.3° | 0.3° |
| C35 | C36 | N37 | H27 | 180.0° | 179.9° |
| C35 | C36 | N37 | C16 | 0.7° | 0.0° |
| C18 | C17 | C16 | H23 | 180.0° | 180.0° |
| C18 | C17 | C16 | N37 | 1.3° | 0.2° |
| C18 | C17 | C16 | N15 | 179.8° | 180.0° |
| C17 | C18 | C19 | H11 | 2.1° | 0.0° |
| C36 | N37 | C16 | C17 | 0.3° | 0.3° |
| C36 | N37 | C16 | N15 | 179.3° | 180.0° |
| C17 | C16 | N37 | N15 | 179.0° | 179.7° |
| C17 | C16 | N15 | C9 | 4.1° | 174.8° |
| C17 | C16 | N15 | H22 | 175.9° | 5.1° |
| O14 | C13 | C12 | N4 | 179.4° | 180.0° |
| O14 | C13 | N4 | C2 | 0.9° | 5.6° |
| O14 | C13 | C12 | N11 | 121.8° | 136.0° |
| O14 | C13 | N4 | C5 | 177.9° | 174.5° |
| O14 | C13 | C12 | H9 | 1.5° | 16.0° |
| O14 | C13 | C12 | H10 | 117.8° | 104.0° |
| N37 | C16 | N15 | C9 | 176.9° | 4.9° |
| N37 | C16 | N15 | H22 | 3.1° | 175.1° |
| N37 | C16 | C17 | H23 | 178.7° | 179.7° |
| C16 | N37 | C36 | H27 | 179.3° | 180.0° |
| C16 | N15 | C9 | N10 | 3.5° | 174.6° |
| C16 | N15 | C9 | H22 | 180.0° | 179.9° |
| C16 | N15 | C9 | C8 | 177.3° | 5.5° |
| N15 | C16 | C17 | H23 | 0.2° | 0.0° |
| C13 | C12 | N11 | N10 | 135.1° | 121.3° |
| C12 | C13 | N4 | C2 | 179.7° | 174.5° |
| C13 | C12 | N11 | H9 | 120.3° | 120.0° |
| C13 | C12 | N11 | H10 | 120.4° | 120.0° |
| C13 | C12 | N11 | C7 | 47.0° | 59.8° |
| C12 | C13 | N4 | C5 | 1.5° | 5.5° |
| C13 | C12 | H9 | H10 | 119.0° | 120.1° |
| C13 | N4 | C2 | C3 | 118.7° | 113.9° |
| C13 | N4 | C2 | C5 | 179.0° | 180.0° |
| C13 | N4 | C2 | C1 | 112.1° | 126.0° |
| N4 | C13 | C12 | N11 | 58.7° | 44.0° |
| C13 | N4 | C5 | C6 | 62.7° | 15.3° |
| C13 | N4 | C2 | H4 | 3.2° | 6.0° |
| N4 | C13 | C12 | H9 | 179.1° | 164.0° |
| N4 | C13 | C12 | H10 | 61.6° | 76.0° |
| C13 | N4 | C5 | H18 | 58.0° | 135.8° |
| C13 | N4 | C5 | H19 | 176.7° | 105.1° |
| C3 | C2 | N4 | C1 | 129.2° | 120.0° |
| C3 | C2 | N4 | H4 | 115.5° | 120.0° |
| C3 | C2 | C1 | H4 | 113.3° | 120.1° |
| C3 | C2 | N4 | C5 | 62.3° | 66.0° |
| C3 | C2 | C1 | H1 | 180.0° | 64.7° |
| C3 | C2 | C1 | H2 | 60.0° | 55.4° |
| C3 | C2 | C1 | H3 | 60.0° | 175.3° |
| C2 | C3 | H5 | H6 | 120.0° | 120.0° |
| C2 | C3 | H5 | H7 | 120.0° | 120.1° |
| C2 | C3 | H6 | H7 | 120.0° | 120.0° |
| N10 | C9 | N15 | C8 | 179.2° | 180.0° |
| C9 | N10 | N11 | C12 | 177.8° | 177.4° |
| C9 | N10 | N11 | C7 | 0.4° | 1.7° |
| N10 | C9 | C8 | C7 | 0.5° | 0.4° |
| N10 | C9 | C8 | H8 | 179.4° | 179.5° |
| N10 | C9 | N15 | H22 | 176.5° | 5.4° |
| N11 | N10 | C9 | N15 | 179.9° | 179.3° |
| N10 | N11 | C12 | C7 | 177.9° | 178.9° |
| N11 | N10 | C9 | C8 | 0.6° | 0.7° |
| N10 | N11 | C7 | C8 | 0.1° | 1.9° |
| N10 | N11 | C7 | C6 | 178.2° | 177.8° |
| N10 | N11 | C12 | H9 | 14.7° | 1.3° |
| N10 | N11 | C12 | H10 | 104.6° | 118.7° |
| N15 | C9 | C8 | C7 | 179.9° | 179.6° |
| N15 | C9 | C8 | H8 | 0.1° | 0.5° |
| N4 | C2 | C1 | H4 | 115.5° | 119.9° |
| C2 | N4 | C5 | C6 | 118.5° | 164.6° |
| N4 | C2 | C1 | H1 | 48.8° | 55.3° |
| N4 | C2 | C1 | H2 | 168.8° | 175.3° |
| N4 | C2 | C1 | H3 | 71.2° | 64.7° |
| N4 | C2 | C3 | H5 | 180.0° | 64.5° |
| N4 | C2 | C3 | H6 | 60.0° | 175.5° |
| N4 | C2 | C3 | H7 | 60.0° | 55.5° |
| C2 | N4 | C5 | H18 | 120.8° | 44.1° |
| C2 | N4 | C5 | H19 | 2.2° | 74.9° |
| C1 | C2 | N4 | C5 | 66.9° | 54.0° |
| C2 | C1 | H1 | H2 | 120.0° | 119.9° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 120.0° | 120.0° |
| C1 | C2 | C3 | H5 | 49.1° | 175.5° |
| C1 | C2 | C3 | H6 | 169.1° | 55.5° |
| C1 | C2 | C3 | H7 | 71.0° | 64.4° |
| C12 | N11 | C7 | C8 | 178.1° | 177.2° |
| C12 | N11 | C7 | C6 | 0.0° | 3.1° |
| N11 | C12 | H9 | H10 | 118.9° | 120.0° |
| C9 | C8 | C7 | N11 | 0.3° | 1.4° |
| C9 | C8 | C7 | H8 | 180.0° | 179.9° |
| C9 | C8 | C7 | C6 | 178.1° | 178.3° |
| C8 | C9 | N15 | H22 | 2.7° | 174.6° |
| N11 | C7 | C8 | C6 | 178.4° | 179.7° |
| N11 | C7 | C6 | C5 | 1.3° | 67.7° |
| N11 | C7 | C8 | H8 | 179.7° | 178.5° |
| C7 | N11 | C12 | H9 | 167.4° | 179.8° |
| C7 | N11 | C12 | H10 | 73.3° | 60.2° |
| N11 | C7 | C6 | H20 | 122.2° | 172.3° |
| N11 | C7 | C6 | H21 | 119.7° | 52.2° |
| N4 | C5 | C6 | C7 | 43.8° | 58.9° |
| N4 | C5 | C6 | H18 | 120.7° | 120.5° |
| N4 | C5 | C6 | H19 | 120.6° | 120.5° |
| C5 | N4 | C2 | H4 | 177.7° | 174.0° |
| N4 | C5 | H18 | H19 | 117.9° | 119.1° |
| N4 | C5 | C6 | H20 | 77.2° | 178.9° |
| N4 | C5 | C6 | H21 | 164.8° | 60.9° |
| C8 | C7 | C6 | C5 | 179.1° | 111.9° |
| C8 | C7 | C6 | H20 | 59.9° | 8.1° |
| C8 | C7 | C6 | H21 | 58.2° | 128.2° |
| C7 | C6 | C5 | H20 | 121.0° | 119.9° |
| C7 | C6 | C5 | H21 | 121.0° | 119.8° |
| C6 | C7 | C8 | H8 | 1.9° | 1.8° |
| C7 | C6 | C5 | H18 | 76.9° | 179.5° |
| C7 | C6 | C5 | H19 | 164.5° | 61.6° |
| C7 | C6 | H20 | H21 | 117.0° | 120.1° |
| C6 | C5 | H18 | H19 | 117.9° | 118.9° |
| C5 | C6 | H20 | H21 | 117.0° | 120.2° |
| H1 | C1 | H2 | H3 | 119.9° | 120.1° |
| H1 | C1 | C2 | H4 | 66.7° | 175.2° |
| H2 | C1 | C2 | H4 | 53.3° | 64.7° |
| H3 | C1 | C2 | H4 | 173.3° | 55.3° |
| H4 | C2 | C3 | H5 | 64.3° | 55.4° |
| H4 | C2 | C3 | H6 | 55.7° | 64.6° |
| H4 | C2 | C3 | H7 | 175.7° | 175.4° |
| H5 | C3 | H6 | H7 | 120.0° | 120.0° |
| H13 | C27 | C26 | H24 | 4.5° | 176.1° |
| H13 | C27 | C26 | H25 | 114.8° | 63.2° |
| H13 | C27 | N28 | H26 | 74.7° | 165.6° |
| H14 | C27 | C26 | H24 | 123.3° | 63.4° |
| H14 | C27 | C26 | H25 | 4.0° | 57.3° |
| H14 | C27 | N28 | H26 | 44.1° | 45.2° |
| H15 | C31 | H16 | H17 | 120.0° | 120.0° |
| H18 | C5 | C6 | H20 | 162.1° | 60.6° |
| H18 | C5 | C6 | H21 | 44.1° | 59.6° |
| H19 | C5 | C6 | H20 | 43.5° | 58.3° |
| H19 | C5 | C6 | H21 | 74.6° | 178.6° |
