1I3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O35 | C34 | doub | 1.22Å | 1.21Å | |
| O33 | C34 | sing | 1.34Å | 1.35Å | |
| O33 | N32 | sing | 1.21Å | 1.22Å | |
| C34 | N36 | sing | 1.36Å | 1.36Å | |
| N32 | C31 | doub | 1.30Å | 1.29Å | |
| N36 | C31 | sing | 1.39Å | 1.39Å | |
| C31 | C1 | sing | 1.48Å | 1.46Å | |
| CL29 | C28 | sing | 1.74Å | 1.71Å | |
| C1 | N23 | doub | 1.33Å | 1.32Å | Aromatic |
| C1 | C2 | sing | 1.39Å | 1.40Å | Aromatic |
| N23 | C22 | sing | 1.32Å | 1.31Å | Aromatic |
| C30 | C28 | doub | 1.39Å | 1.39Å | Aromatic |
| C30 | C24 | sing | 1.40Å | 1.38Å | Aromatic |
| C28 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C2 | C3 | doub | 1.40Å | 1.40Å | Aromatic |
| C24 | C22 | sing | 1.48Å | 1.49Å | |
| C24 | C25 | doub | 1.39Å | 1.41Å | Aromatic |
| C22 | C21 | doub | 1.40Å | 1.42Å | Aromatic |
| C27 | N26 | doub | 1.32Å | 1.32Å | Aromatic |
| C25 | N26 | sing | 1.32Å | 1.34Å | Aromatic |
| C3 | C21 | sing | 1.41Å | 1.42Å | Aromatic |
| C3 | N4 | sing | 1.35Å | 1.35Å | Aromatic |
| C21 | N11 | sing | 1.38Å | 1.38Å | Aromatic |
| C15 | C16 | sing | 1.53Å | 1.54Å | |
| C15 | C14 | sing | 1.53Å | 1.55Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| N4 | C5 | doub | 1.30Å | 1.30Å | Aromatic |
| N11 | C12 | sing | 1.47Å | 1.49Å | |
| N11 | C5 | sing | 1.36Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| C17 | C19 | sing | 1.53Å | 1.53Å | |
| C12 | C14 | sing | 1.53Å | 1.56Å | |
| C12 | C13 | sing | 1.53Å | 1.55Å | |
| C5 | C6 | sing | 1.51Å | 1.54Å | |
| C14 | C20 | sing | 1.53Å | 1.54Å | |
| C10 | O9 | sing | 1.43Å | 1.43Å | |
| C20 | C19 | sing | 1.53Å | 1.55Å | |
| O9 | C8 | sing | 1.43Å | 1.44Å | |
| C6 | C8 | sing | 1.53Å | 1.52Å | |
| C6 | C7 | sing | 1.53Å | 1.55Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| C6 | H2 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C27 | H19 | sing | 1.08Å | 1.08Å | |
| C30 | H20 | sing | 1.08Å | 1.08Å | |
| C10 | H21 | sing | 1.09Å | 1.10Å | |
| C10 | H22 | sing | 1.09Å | 1.10Å | |
| C10 | H23 | sing | 1.09Å | 1.10Å | |
| C13 | H24 | sing | 1.09Å | 1.10Å | |
| C13 | H25 | sing | 1.09Å | 1.10Å | |
| C13 | H26 | sing | 1.09Å | 1.10Å | |
| C14 | H27 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C20 | H29 | sing | 1.09Å | 1.10Å | |
| C25 | H30 | sing | 1.08Å | 1.08Å | |
| N36 | H31 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O35 | C34 | O33 | 126.3° | 126.9° |
| O35 | C34 | N36 | 126.8° | 126.8° |
| C34 | O33 | N32 | 110.1° | 110.8° |
| O33 | C34 | N36 | 107.0° | 106.3° |
| O33 | N32 | C31 | 111.5° | 111.6° |
| C34 | N36 | C31 | 103.3° | 104.3° |
| C34 | N36 | H31 | 128.3° | 127.8° |
| N32 | C31 | N36 | 108.1° | 106.9° |
| N32 | C31 | C1 | 123.9° | 126.5° |
| N36 | C31 | C1 | 127.9° | 126.6° |
| C31 | N36 | H31 | 128.3° | 127.8° |
| C31 | C1 | N23 | 113.6° | 119.4° |
| C31 | C1 | C2 | 123.8° | 119.4° |
| CL29 | C28 | C30 | 118.5° | 120.3° |
| CL29 | C28 | C27 | 120.4° | 120.4° |
| N23 | C1 | C2 | 122.6° | 121.2° |
| C1 | N23 | C22 | 123.2° | 122.1° |
| C1 | C2 | C3 | 116.9° | 118.9° |
| C1 | C2 | H1 | 121.5° | 120.6° |
| N23 | C22 | C24 | 116.9° | 119.9° |
| N23 | C22 | C21 | 119.3° | 120.3° |
| C28 | C30 | C24 | 118.2° | 118.2° |
| C30 | C28 | C27 | 121.1° | 119.3° |
| C28 | C30 | H20 | 120.9° | 120.9° |
| C30 | C24 | C22 | 121.8° | 120.5° |
| C30 | C24 | C25 | 117.9° | 119.0° |
| C24 | C30 | H20 | 120.9° | 120.9° |
| C28 | C27 | N26 | 120.0° | 121.0° |
| C28 | C27 | H19 | 120.0° | 119.5° |
| C2 | C3 | C21 | 119.0° | 118.3° |
| C2 | C3 | N4 | 133.6° | 134.7° |
| C3 | C2 | H1 | 121.6° | 120.5° |
| C22 | C24 | C25 | 120.3° | 120.6° |
| C24 | C22 | C21 | 123.8° | 119.8° |
| C24 | C25 | N26 | 121.7° | 120.6° |
| C24 | C25 | H30 | 119.2° | 119.7° |
| C22 | C21 | C3 | 118.9° | 119.2° |
| C22 | C21 | N11 | 135.7° | 134.9° |
| C27 | N26 | C25 | 121.1° | 121.9° |
| N26 | C27 | H19 | 120.0° | 119.5° |
| N26 | C25 | H30 | 119.2° | 119.7° |
| C21 | C3 | N4 | 107.4° | 107.0° |
| C3 | C21 | N11 | 105.4° | 106.0° |
| C3 | N4 | C5 | 110.4° | 109.6° |
| C21 | N11 | C12 | 126.1° | 126.3° |
| C21 | N11 | C5 | 107.1° | 107.4° |
| C16 | C15 | C14 | 113.2° | 109.4° |
| C15 | C16 | C17 | 112.2° | 109.5° |
| C16 | C15 | H9 | 108.5° | 109.4° |
| C16 | C15 | H10 | 108.5° | 109.4° |
| C15 | C16 | H11 | 108.8° | 109.5° |
| C15 | C16 | H12 | 108.8° | 109.4° |
| C15 | C14 | C12 | 114.2° | 109.4° |
| C15 | C14 | C20 | 106.1° | 109.5° |
| C14 | C15 | H9 | 108.5° | 109.5° |
| C14 | C15 | H10 | 108.6° | 109.5° |
| C15 | C14 | H27 | 108.9° | 109.5° |
| C16 | C17 | C18 | 112.1° | 109.4° |
| C16 | C17 | C19 | 109.4° | 109.5° |
| C17 | C16 | H11 | 108.8° | 109.5° |
| C17 | C16 | H12 | 108.8° | 109.5° |
| C16 | C17 | H13 | 108.2° | 109.4° |
| N4 | C5 | N11 | 109.6° | 110.1° |
| N4 | C5 | C6 | 122.7° | 125.0° |
| C12 | N11 | C5 | 126.6° | 126.3° |
| N11 | C12 | C14 | 108.2° | 109.5° |
| N11 | C12 | C13 | 112.1° | 109.4° |
| N11 | C12 | H8 | 107.3° | 109.5° |
| N11 | C5 | C6 | 127.7° | 124.9° |
| C18 | C17 | C19 | 110.7° | 109.5° |
| C18 | C17 | H13 | 108.2° | 109.5° |
| C17 | C18 | H14 | 109.5° | 109.5° |
| C17 | C18 | H15 | 109.5° | 109.4° |
| C17 | C18 | H16 | 109.5° | 109.5° |
| C17 | C19 | C20 | 108.5° | 109.5° |
| C19 | C17 | H13 | 108.3° | 109.5° |
| C17 | C19 | H17 | 109.7° | 109.5° |
| C17 | C19 | H18 | 109.7° | 109.5° |
| C14 | C12 | C13 | 115.6° | 109.5° |
| C12 | C14 | C20 | 109.5° | 109.5° |
| C14 | C12 | H8 | 106.5° | 109.5° |
| C12 | C14 | H27 | 108.8° | 109.5° |
| C13 | C12 | H8 | 106.6° | 109.4° |
| C12 | C13 | H24 | 109.5° | 109.5° |
| C12 | C13 | H25 | 109.5° | 109.5° |
| C12 | C13 | H26 | 109.5° | 109.5° |
| C5 | C6 | C8 | 110.6° | 109.4° |
| C5 | C6 | C7 | 112.2° | 109.4° |
| C5 | C6 | H2 | 108.3° | 109.5° |
| C14 | C20 | C19 | 112.7° | 109.5° |
| C20 | C14 | H27 | 109.1° | 109.5° |
| C14 | C20 | H28 | 108.7° | 109.5° |
| C14 | C20 | H29 | 108.7° | 109.5° |
| C10 | O9 | C8 | 116.3° | 114.0° |
| O9 | C10 | H21 | 109.5° | 109.4° |
| O9 | C10 | H22 | 109.5° | 109.4° |
| O9 | C10 | H23 | 109.5° | 109.4° |
| C20 | C19 | H17 | 109.7° | 109.5° |
| C20 | C19 | H18 | 109.7° | 109.4° |
| C19 | C20 | H28 | 108.7° | 109.4° |
| C19 | C20 | H29 | 108.7° | 109.5° |
| O9 | C8 | C6 | 110.3° | 109.4° |
| O9 | C8 | H6 | 109.3° | 109.5° |
| O9 | C8 | H7 | 109.3° | 109.5° |
| C8 | C6 | C7 | 109.1° | 109.5° |
| C8 | C6 | H2 | 108.4° | 109.5° |
| C6 | C8 | H6 | 109.3° | 109.5° |
| C6 | C8 | H7 | 109.3° | 109.5° |
| C7 | C6 | H2 | 108.2° | 109.5° |
| C6 | C7 | H3 | 109.5° | 109.5° |
| C6 | C7 | H4 | 109.4° | 109.5° |
| C6 | C7 | H5 | 109.5° | 109.4° |
| H3 | C7 | H4 | 109.5° | 109.5° |
| H3 | C7 | H5 | 109.5° | 109.4° |
| H4 | C7 | H5 | 109.5° | 109.5° |
| H6 | C8 | H7 | 109.5° | 109.5° |
| H9 | C15 | H10 | 109.4° | 109.5° |
| H11 | C16 | H12 | 109.5° | 109.4° |
| H14 | C18 | H15 | 109.5° | 109.4° |
| H14 | C18 | H16 | 109.5° | 109.5° |
| H15 | C18 | H16 | 109.5° | 109.5° |
| H17 | C19 | H18 | 109.5° | 109.5° |
| H21 | C10 | H22 | 109.5° | 109.5° |
| H21 | C10 | H23 | 109.5° | 109.5° |
| H22 | C10 | H23 | 109.4° | 109.5° |
| H24 | C13 | H25 | 109.4° | 109.5° |
| H24 | C13 | H26 | 109.5° | 109.5° |
| H25 | C13 | H26 | 109.4° | 109.4° |
| H28 | C20 | H29 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O35 | C34 | O33 | N36 | 178.9° | 179.5° |
| O35 | C34 | O33 | N32 | 177.5° | 179.8° |
| O35 | C34 | N36 | C31 | 179.0° | 180.0° |
| O35 | C34 | N36 | H31 | 1.0° | 0.5° |
| C34 | O33 | N32 | C31 | 2.5° | 0.0° |
| O33 | C34 | N36 | C31 | 0.1° | 0.4° |
| O33 | C34 | N36 | H31 | 179.9° | 180.0° |
| N32 | O33 | C34 | N36 | 1.5° | 0.3° |
| O33 | N32 | C31 | N36 | 2.5° | 0.3° |
| O33 | N32 | C31 | C1 | 179.1° | 180.0° |
| C34 | N36 | C31 | N32 | 1.5° | 0.4° |
| C34 | N36 | C31 | H31 | 180.0° | 179.6° |
| C34 | N36 | C31 | C1 | 177.8° | 179.8° |
| N32 | C31 | N36 | C1 | 176.4° | 179.7° |
| N32 | C31 | C1 | N23 | 4.5° | 179.9° |
| N32 | C31 | C1 | C2 | 176.3° | 0.2° |
| N32 | C31 | N36 | H31 | 178.5° | 180.0° |
| N36 | C31 | C1 | N23 | 179.7° | 0.3° |
| N36 | C31 | C1 | C2 | 0.5° | 179.4° |
| C31 | C1 | N23 | C2 | 179.2° | 179.7° |
| C31 | C1 | N23 | C22 | 178.4° | 179.7° |
| C31 | C1 | C2 | C3 | 179.2° | 179.7° |
| C31 | C1 | C2 | H1 | 0.8° | 0.3° |
| C1 | C31 | N36 | H31 | 2.2° | 0.3° |
| CL29 | C28 | C30 | C27 | 179.0° | 180.0° |
| CL29 | C28 | C30 | C24 | 179.0° | 180.0° |
| CL29 | C28 | C27 | N26 | 179.1° | 179.7° |
| CL29 | C28 | C27 | H19 | 0.9° | 0.1° |
| CL29 | C28 | C30 | H20 | 1.1° | 0.0° |
| N23 | C1 | C2 | C3 | 1.7° | 0.0° |
| C1 | N23 | C22 | C24 | 179.1° | 180.0° |
| C1 | N23 | C22 | C21 | 1.4° | 0.0° |
| N23 | C1 | C2 | H1 | 178.3° | 180.0° |
| C2 | C1 | N23 | C22 | 2.4° | 0.0° |
| C1 | C2 | C3 | H1 | 180.0° | 180.0° |
| C1 | C2 | C3 | C21 | 0.2° | 0.0° |
| C1 | C2 | C3 | N4 | 178.3° | 180.0° |
| N23 | C22 | C24 | C30 | 73.3° | 53.4° |
| N23 | C22 | C24 | C21 | 177.6° | 180.0° |
| N23 | C22 | C24 | C25 | 107.3° | 126.3° |
| N23 | C22 | C21 | C3 | 0.2° | 0.0° |
| N23 | C22 | C21 | N11 | 179.9° | 180.0° |
| C28 | C30 | C24 | H20 | 180.0° | 180.0° |
| C28 | C30 | C24 | C22 | 178.2° | 180.0° |
| C28 | C30 | C24 | C25 | 1.2° | 0.3° |
| C30 | C28 | C27 | N26 | 1.9° | 0.2° |
| C30 | C28 | C27 | H19 | 178.1° | 180.0° |
| C24 | C30 | C28 | C27 | 2.0° | 0.0° |
| C30 | C24 | C22 | C25 | 179.4° | 179.7° |
| C30 | C24 | C22 | C21 | 109.1° | 126.6° |
| C30 | C24 | C25 | N26 | 0.3° | 0.2° |
| C30 | C24 | C25 | H30 | 179.7° | 179.8° |
| C28 | C27 | N26 | H19 | 180.0° | 179.8° |
| C28 | C27 | N26 | C25 | 0.9° | 0.3° |
| C27 | C28 | C30 | H20 | 177.9° | 180.0° |
| C2 | C3 | C21 | C22 | 0.7° | 0.0° |
| C2 | C3 | C21 | N4 | 178.8° | 180.0° |
| C2 | C3 | C21 | N11 | 179.4° | 180.0° |
| C2 | C3 | N4 | C5 | 178.8° | 180.0° |
| C22 | C24 | C25 | N26 | 179.1° | 180.0° |
| C24 | C22 | C21 | C3 | 177.4° | 180.0° |
| C24 | C22 | C21 | N11 | 2.5° | 0.0° |
| C22 | C24 | C30 | H20 | 1.8° | 0.0° |
| C22 | C24 | C25 | H30 | 0.9° | 0.1° |
| C25 | C24 | C22 | C21 | 70.4° | 53.7° |
| C24 | C25 | N26 | C27 | 0.1° | 0.0° |
| C24 | C25 | N26 | H30 | 180.0° | 179.9° |
| C25 | C24 | C30 | H20 | 178.7° | 179.7° |
| C22 | C21 | C3 | N11 | 179.9° | 180.0° |
| C22 | C21 | C3 | N4 | 179.5° | 180.0° |
| C22 | C21 | N11 | C12 | 4.2° | 0.0° |
| C22 | C21 | N11 | C5 | 179.4° | 180.0° |
| C27 | N26 | C25 | H30 | 179.9° | 179.9° |
| C25 | N26 | C27 | H19 | 179.1° | 179.9° |
| C21 | C3 | N4 | C5 | 0.2° | 0.0° |
| C3 | C21 | N11 | C12 | 175.8° | 180.0° |
| C3 | C21 | N11 | C5 | 0.6° | 0.0° |
| C21 | C3 | C2 | H1 | 179.9° | 180.0° |
| N4 | C3 | C21 | N11 | 0.5° | 0.0° |
| C3 | N4 | C5 | N11 | 0.2° | 0.0° |
| C3 | N4 | C5 | C6 | 179.7° | 180.0° |
| N4 | C3 | C2 | H1 | 1.7° | 0.0° |
| C21 | N11 | C5 | N4 | 0.6° | 0.0° |
| C21 | N11 | C12 | C5 | 174.3° | 179.9° |
| C21 | N11 | C12 | C14 | 105.7° | 121.6° |
| C21 | N11 | C12 | C13 | 125.6° | 118.5° |
| C21 | N11 | C5 | C6 | 179.4° | 180.0° |
| C21 | N11 | C12 | H8 | 8.9° | 1.5° |
| C16 | C15 | C14 | H9 | 120.6° | 120.0° |
| C16 | C15 | C14 | H10 | 120.5° | 119.9° |
| C15 | C16 | C17 | H11 | 120.4° | 120.0° |
| C15 | C16 | C17 | H12 | 120.4° | 119.9° |
| C15 | C16 | C17 | C18 | 178.7° | 180.0° |
| C15 | C16 | C17 | C19 | 55.6° | 60.0° |
| C16 | C15 | C14 | C12 | 175.1° | 180.0° |
| C16 | C15 | C14 | C20 | 54.3° | 60.0° |
| C16 | C15 | H9 | H10 | 118.3° | 120.0° |
| C15 | C16 | H11 | H12 | 118.8° | 119.9° |
| C15 | C16 | C17 | H13 | 62.2° | 60.0° |
| C16 | C15 | C14 | H27 | 63.0° | 60.1° |
| C14 | C15 | C16 | C17 | 54.9° | 60.0° |
| C15 | C14 | C12 | N11 | 49.8° | 55.3° |
| C15 | C14 | C12 | C20 | 118.8° | 120.0° |
| C15 | C14 | C12 | H27 | 122.0° | 120.0° |
| C15 | C14 | C12 | C13 | 176.4° | 175.3° |
| C15 | C14 | C20 | H27 | 117.2° | 120.0° |
| C15 | C14 | C20 | C19 | 59.4° | 60.0° |
| C15 | C14 | C12 | H8 | 65.4° | 64.7° |
| C14 | C15 | H9 | H10 | 118.3° | 120.1° |
| C14 | C15 | C16 | H11 | 175.3° | 180.0° |
| C14 | C15 | C16 | H12 | 65.5° | 60.1° |
| C15 | C14 | C20 | H28 | 179.8° | 60.0° |
| C15 | C14 | C20 | H29 | 61.1° | 179.9° |
| C16 | C17 | C18 | C19 | 122.4° | 120.0° |
| C16 | C17 | C18 | H13 | 119.2° | 119.9° |
| C16 | C17 | C19 | H13 | 117.7° | 120.0° |
| C16 | C17 | C19 | C20 | 58.6° | 60.0° |
| C17 | C16 | C15 | H9 | 175.5° | 180.0° |
| C17 | C16 | C15 | H10 | 65.7° | 60.0° |
| C17 | C16 | H11 | H12 | 118.7° | 120.1° |
| C16 | C17 | C18 | H14 | 180.0° | 60.1° |
| C16 | C17 | C18 | H15 | 60.0° | 180.0° |
| C16 | C17 | C18 | H16 | 60.0° | 60.0° |
| C16 | C17 | C19 | H17 | 178.4° | 180.0° |
| C16 | C17 | C19 | H18 | 61.3° | 60.0° |
| N4 | C5 | N11 | C12 | 175.7° | 180.0° |
| N4 | C5 | N11 | C6 | 179.9° | 180.0° |
| N4 | C5 | C6 | C8 | 54.7° | 60.0° |
| N4 | C5 | C6 | C7 | 67.3° | 60.0° |
| N4 | C5 | C6 | H2 | 173.4° | 180.0° |
| N11 | C12 | C14 | C13 | 126.6° | 120.0° |
| N11 | C12 | C14 | H8 | 115.1° | 120.1° |
| N11 | C12 | C13 | H8 | 117.2° | 120.0° |
| C12 | N11 | C5 | C6 | 4.2° | 0.1° |
| N11 | C12 | C14 | C20 | 168.6° | 175.3° |
| N11 | C12 | C13 | H24 | 180.0° | 53.5° |
| N11 | C12 | C13 | H25 | 60.0° | 173.5° |
| N11 | C12 | C13 | H26 | 60.0° | 66.5° |
| N11 | C12 | C14 | H27 | 72.2° | 64.6° |
| C5 | N11 | C12 | C14 | 68.6° | 58.4° |
| C5 | N11 | C12 | C13 | 60.1° | 61.6° |
| N11 | C5 | C6 | C8 | 125.2° | 120.1° |
| N11 | C5 | C6 | C7 | 112.7° | 119.9° |
| N11 | C5 | C6 | H2 | 6.5° | 0.1° |
| C5 | N11 | C12 | H8 | 176.9° | 178.5° |
| C18 | C17 | C19 | H13 | 118.4° | 120.0° |
| C18 | C17 | C19 | C20 | 177.5° | 180.0° |
| C18 | C17 | C16 | H11 | 60.9° | 60.0° |
| C18 | C17 | C16 | H12 | 58.2° | 60.1° |
| C17 | C18 | H14 | H15 | 120.0° | 119.9° |
| C17 | C18 | H14 | H16 | 120.0° | 120.1° |
| C17 | C18 | H15 | H16 | 120.0° | 120.1° |
| C18 | C17 | C19 | H17 | 57.6° | 60.0° |
| C18 | C17 | C19 | H18 | 62.6° | 60.0° |
| C17 | C19 | C20 | C14 | 63.6° | 60.0° |
| C17 | C19 | C20 | H17 | 119.9° | 120.1° |
| C17 | C19 | C20 | H18 | 119.9° | 120.0° |
| C19 | C17 | C16 | H11 | 176.0° | 180.0° |
| C19 | C17 | C16 | H12 | 64.9° | 60.0° |
| C19 | C17 | C18 | H14 | 57.7° | 60.0° |
| C19 | C17 | C18 | H15 | 177.7° | 60.0° |
| C19 | C17 | C18 | H16 | 62.4° | 180.0° |
| C17 | C19 | H17 | H18 | 120.4° | 120.0° |
| C17 | C19 | C20 | H28 | 176.0° | 60.0° |
| C17 | C19 | C20 | H29 | 56.9° | 180.0° |
| C14 | C12 | C13 | H8 | 118.2° | 120.0° |
| C12 | C14 | C20 | H27 | 119.1° | 120.0° |
| C12 | C14 | C20 | C19 | 176.9° | 180.0° |
| C12 | C14 | C15 | H9 | 64.4° | 60.1° |
| C12 | C14 | C15 | H10 | 54.5° | 60.1° |
| C14 | C12 | C13 | H24 | 55.4° | 173.5° |
| C14 | C12 | C13 | H25 | 64.6° | 66.5° |
| C14 | C12 | C13 | H26 | 175.4° | 53.5° |
| C12 | C14 | C20 | H28 | 56.4° | 60.0° |
| C12 | C14 | C20 | H29 | 62.6° | 60.0° |
| C13 | C12 | C14 | C20 | 64.8° | 64.7° |
| C12 | C13 | H24 | H25 | 120.0° | 120.1° |
| C12 | C13 | H24 | H26 | 120.0° | 120.0° |
| C12 | C13 | H25 | H26 | 120.0° | 120.0° |
| C13 | C12 | C14 | H27 | 54.4° | 55.3° |
| C5 | C6 | C8 | O9 | 56.4° | 175.0° |
| C5 | C6 | C8 | C7 | 123.8° | 119.9° |
| C5 | C6 | C8 | H2 | 118.6° | 120.0° |
| C5 | C6 | C7 | H2 | 119.4° | 120.0° |
| C5 | C6 | C7 | H3 | 180.0° | 60.0° |
| C5 | C6 | C7 | H4 | 60.0° | 60.0° |
| C5 | C6 | C7 | H5 | 60.0° | 179.9° |
| C5 | C6 | C8 | H6 | 176.5° | 55.0° |
| C5 | C6 | C8 | H7 | 63.7° | 65.0° |
| C14 | C20 | C19 | H28 | 120.5° | 120.0° |
| C14 | C20 | C19 | H29 | 120.5° | 120.0° |
| C20 | C14 | C12 | H8 | 53.4° | 55.2° |
| C20 | C14 | C15 | H9 | 174.9° | 180.0° |
| C20 | C14 | C15 | H10 | 66.2° | 59.9° |
| C14 | C20 | C19 | H17 | 176.5° | 180.0° |
| C14 | C20 | C19 | H18 | 56.3° | 60.0° |
| C14 | C20 | H28 | H29 | 118.6° | 120.0° |
| C10 | O9 | C8 | C6 | 157.8° | 180.0° |
| C10 | O9 | C8 | H6 | 82.1° | 60.0° |
| C10 | O9 | C8 | H7 | 37.7° | 60.1° |
| O9 | C10 | H21 | H22 | 120.0° | 120.0° |
| O9 | C10 | H21 | H23 | 120.0° | 120.0° |
| O9 | C10 | H22 | H23 | 120.0° | 120.0° |
| C20 | C19 | C17 | H13 | 59.1° | 60.0° |
| C20 | C19 | H17 | H18 | 120.4° | 120.0° |
| C19 | C20 | C14 | H27 | 57.8° | 60.0° |
| C19 | C20 | H28 | H29 | 118.5° | 120.0° |
| O9 | C8 | C6 | H6 | 120.1° | 120.0° |
| O9 | C8 | C6 | H7 | 120.1° | 120.0° |
| O9 | C8 | C6 | C7 | 179.8° | 65.0° |
| O9 | C8 | C6 | H2 | 62.2° | 55.0° |
| O9 | C8 | H6 | H7 | 119.6° | 120.0° |
| C8 | O9 | C10 | H21 | 180.0° | 60.0° |
| C8 | O9 | C10 | H22 | 60.0° | 60.0° |
| C8 | O9 | C10 | H23 | 60.0° | 179.9° |
| C8 | C6 | C7 | H2 | 117.7° | 120.1° |
| C8 | C6 | C7 | H3 | 57.1° | 59.9° |
| C8 | C6 | C7 | H4 | 62.9° | 180.0° |
| C8 | C6 | C7 | H5 | 177.1° | 60.0° |
| C6 | C8 | H6 | H7 | 119.6° | 120.0° |
| C6 | C7 | H3 | H4 | 120.0° | 120.0° |
| C6 | C7 | H3 | H5 | 120.0° | 120.0° |
| C6 | C7 | H4 | H5 | 120.0° | 120.0° |
| C7 | C6 | C8 | H6 | 59.7° | 175.0° |
| C7 | C6 | C8 | H7 | 60.1° | 54.9° |
| H2 | C6 | C7 | H3 | 60.7° | NaN° |
| H2 | C6 | C7 | H4 | 179.3° | 60.0° |
| H2 | C6 | C7 | H5 | 59.4° | 60.1° |
| H2 | C6 | C8 | H6 | 57.9° | 65.0° |
| H2 | C6 | C8 | H7 | 177.7° | 175.0° |
| H3 | C7 | H4 | H5 | 120.0° | 120.0° |
| H8 | C12 | C13 | H24 | 62.8° | 66.5° |
| H8 | C12 | C13 | H25 | 177.2° | 53.5° |
| H8 | C12 | C13 | H26 | 57.2° | 173.5° |
| H8 | C12 | C14 | H27 | 172.7° | 175.3° |
| H9 | C15 | C16 | H11 | 64.1° | 60.0° |
| H9 | C15 | C16 | H12 | 55.1° | 60.0° |
| H9 | C15 | C14 | H27 | 57.5° | 59.9° |
| H10 | C15 | C16 | H11 | 54.7° | 60.1° |
| H10 | C15 | C16 | H12 | 173.9° | 180.0° |
| H10 | C15 | C14 | H27 | 176.4° | 180.0° |
| H11 | C16 | C17 | H13 | 58.3° | 60.0° |
| H12 | C16 | C17 | H13 | 177.4° | 180.0° |
| H13 | C17 | C18 | H14 | 60.8° | 180.0° |
| H13 | C17 | C18 | H15 | 59.2° | 60.1° |
| H13 | C17 | C18 | H16 | 179.2° | 60.0° |
| H13 | C17 | C19 | H17 | 60.7° | 60.0° |
| H13 | C17 | C19 | H18 | 179.0° | 180.0° |
| H14 | C18 | H15 | H16 | 120.0° | 120.0° |
| H17 | C19 | C20 | H28 | 56.1° | 60.0° |
| H17 | C19 | C20 | H29 | 63.0° | 59.9° |
| H18 | C19 | C20 | H28 | 64.2° | 180.0° |
| H18 | C19 | C20 | H29 | 176.8° | 60.0° |
| H21 | C10 | H22 | H23 | 120.0° | 120.1° |
| H24 | C13 | H25 | H26 | 120.0° | 120.0° |
| H27 | C14 | C20 | H28 | 62.6° | 180.0° |
| H27 | C14 | C20 | H29 | 178.3° | 60.0° |
