A1A9P
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | C24 | sing | 1.54Å | 1.50Å | |
| C23 | C22 | sing | 1.55Å | 1.50Å | |
| C24 | N20 | sing | 1.47Å | 1.46Å | |
| C22 | C21 | sing | 1.55Å | 1.52Å | |
| N20 | C21 | sing | 1.47Å | 1.47Å | |
| N20 | C18 | sing | 1.35Å | 1.35Å | |
| O19 | C18 | doub | 1.21Å | 1.22Å | |
| C18 | C17 | sing | 1.51Å | 1.54Å | |
| N25 | C17 | sing | 1.47Å | 1.49Å | |
| C17 | C14 | sing | 1.53Å | 1.54Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| C16 | N11 | sing | 1.47Å | 1.46Å | |
| C12 | N11 | sing | 1.47Å | 1.46Å | |
| N11 | C7 | sing | 1.38Å | 1.37Å | |
| C1 | C2 | sing | 1.51Å | 1.50Å | |
| C7 | N8 | doub | 1.33Å | 1.34Å | Aromatic |
| C7 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| C2 | C6 | sing | 1.46Å | 1.45Å | Aromatic |
| C2 | C3 | doub | 1.34Å | 1.37Å | Aromatic |
| N8 | C9 | sing | 1.32Å | 1.34Å | Aromatic |
| C6 | C5 | doub | 1.41Å | 1.39Å | Aromatic |
| C3 | C33 | sing | 1.51Å | 1.49Å | |
| C3 | N4 | sing | 1.37Å | 1.39Å | Aromatic |
| C9 | N10 | doub | 1.32Å | 1.34Å | Aromatic |
| C5 | N4 | sing | 1.37Å | 1.39Å | Aromatic |
| C5 | N10 | sing | 1.33Å | 1.34Å | Aromatic |
| N4 | C26 | sing | 1.40Å | 1.44Å | |
| C26 | C31 | doub | 1.39Å | 1.39Å | Aromatic |
| C26 | C27 | sing | 1.39Å | 1.39Å | Aromatic |
| C31 | C30 | sing | 1.38Å | 1.38Å | Aromatic |
| C27 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C30 | C29 | doub | 1.38Å | 1.38Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | BR32 | sing | 1.89Å | 1.90Å | |
| C33 | H1 | sing | 1.09Å | 1.10Å | |
| C33 | H2 | sing | 1.09Å | 1.10Å | |
| C33 | H3 | sing | 1.09Å | 1.10Å | |
| C9 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H25 | sing | 1.09Å | 1.10Å | |
| C27 | H26 | sing | 1.08Å | 1.08Å | |
| C28 | H27 | sing | 1.08Å | 1.08Å | |
| C30 | H28 | sing | 1.08Å | 1.08Å | |
| C31 | H29 | sing | 1.08Å | 1.08Å | |
| N25 | H30 | sing | 1.01Å | 1.00Å | |
| N25 | H31 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | C23 | C22 | 103.2° | 103.0° |
| C23 | C24 | N20 | 102.8° | 107.3° |
| C24 | C23 | H22 | 111.0° | 110.7° |
| C24 | C23 | H23 | 111.0° | 110.8° |
| C23 | C24 | H24 | 111.1° | 109.9° |
| C23 | C24 | H25 | 111.1° | 109.8° |
| C23 | C22 | C21 | 103.5° | 101.6° |
| C23 | C22 | H20 | 111.0° | 111.0° |
| C23 | C22 | H21 | 111.0° | 111.0° |
| C22 | C23 | H22 | 111.0° | 110.7° |
| C22 | C23 | H23 | 111.0° | 110.7° |
| C24 | N20 | C21 | 111.0° | 108.5° |
| C24 | N20 | C18 | 123.0° | 125.7° |
| N20 | C24 | H24 | 111.1° | 109.9° |
| N20 | C24 | H25 | 111.1° | 109.9° |
| C22 | C21 | N20 | 103.5° | 104.9° |
| C22 | C21 | H7 | 110.9° | 110.3° |
| C22 | C21 | H8 | 111.0° | 110.4° |
| C21 | C22 | H20 | 111.0° | 111.0° |
| C21 | C22 | H21 | 111.0° | 111.0° |
| C21 | N20 | C18 | 126.0° | 125.8° |
| N20 | C21 | H7 | 110.9° | 110.4° |
| N20 | C21 | H8 | 110.9° | 110.4° |
| N20 | C18 | O19 | 121.8° | 120.0° |
| N20 | C18 | C17 | 118.2° | 120.1° |
| O19 | C18 | C17 | 120.0° | 119.9° |
| C18 | C17 | N25 | 107.3° | 109.5° |
| C18 | C17 | C14 | 112.8° | 109.4° |
| C18 | C17 | H19 | 107.9° | 109.4° |
| N25 | C17 | C14 | 112.5° | 109.5° |
| N25 | C17 | H19 | 108.5° | 109.5° |
| C17 | N25 | H30 | 109.5° | 111.0° |
| C17 | N25 | H31 | 109.5° | 111.0° |
| C17 | C14 | C15 | 111.8° | 109.5° |
| C17 | C14 | C13 | 112.9° | 109.5° |
| C17 | C14 | H16 | 107.6° | 109.6° |
| C14 | C17 | H19 | 107.8° | 109.5° |
| C15 | C14 | C13 | 109.0° | 109.2° |
| C14 | C15 | C16 | 109.8° | 109.2° |
| C15 | C14 | H16 | 107.7° | 109.5° |
| C14 | C15 | H17 | 109.4° | 109.5° |
| C14 | C15 | H18 | 109.4° | 109.5° |
| C14 | C13 | C12 | 109.0° | 109.3° |
| C14 | C13 | H5 | 109.6° | 109.5° |
| C14 | C13 | H6 | 109.6° | 109.5° |
| C13 | C14 | H16 | 107.7° | 109.5° |
| C15 | C16 | N11 | 112.6° | 109.5° |
| C15 | C16 | H9 | 108.7° | 109.5° |
| C15 | C16 | H10 | 108.7° | 109.4° |
| C16 | C15 | H17 | 109.4° | 109.5° |
| C16 | C15 | H18 | 109.4° | 109.5° |
| C13 | C12 | N11 | 112.1° | 109.5° |
| C12 | C13 | H5 | 109.6° | 109.5° |
| C12 | C13 | H6 | 109.6° | 109.5° |
| C13 | C12 | H14 | 108.8° | 109.5° |
| C13 | C12 | H15 | 108.8° | 109.4° |
| C16 | N11 | C12 | 109.1° | 111.2° |
| C16 | N11 | C7 | 117.6° | 111.0° |
| N11 | C16 | H9 | 108.7° | 109.5° |
| N11 | C16 | H10 | 108.7° | 109.4° |
| C12 | N11 | C7 | 119.4° | 110.9° |
| N11 | C12 | H14 | 108.8° | 109.5° |
| N11 | C12 | H15 | 108.8° | 109.4° |
| N11 | C7 | N8 | 117.0° | 120.9° |
| N11 | C7 | C6 | 121.3° | 120.8° |
| C1 | C2 | C6 | 126.7° | 126.6° |
| C1 | C2 | C3 | 125.8° | 126.6° |
| C2 | C1 | H11 | 109.5° | 109.5° |
| C2 | C1 | H12 | 109.4° | 109.5° |
| C2 | C1 | H13 | 109.5° | 109.5° |
| N8 | C7 | C6 | 121.6° | 118.3° |
| C7 | N8 | C9 | 115.8° | 121.1° |
| C7 | C6 | C2 | 138.1° | 135.1° |
| C7 | C6 | C5 | 115.1° | 118.7° |
| C6 | C2 | C3 | 107.5° | 106.8° |
| C2 | C6 | C5 | 106.8° | 106.3° |
| C2 | C3 | C33 | 129.2° | 125.1° |
| C2 | C3 | N4 | 108.9° | 109.8° |
| N8 | C9 | N10 | 129.4° | 122.7° |
| N8 | C9 | H4 | 115.3° | 118.7° |
| C6 | C5 | N4 | 108.0° | 107.2° |
| C6 | C5 | N10 | 125.8° | 118.6° |
| C33 | C3 | N4 | 121.9° | 125.1° |
| C3 | C33 | H1 | 109.5° | 109.5° |
| C3 | C33 | H2 | 109.5° | 109.4° |
| C3 | C33 | H3 | 109.5° | 109.5° |
| C3 | N4 | C5 | 108.9° | 109.9° |
| C3 | N4 | C26 | 126.4° | 125.0° |
| C9 | N10 | C5 | 112.2° | 120.7° |
| N10 | C9 | H4 | 115.3° | 118.6° |
| N4 | C5 | N10 | 126.2° | 134.2° |
| C5 | N4 | C26 | 124.5° | 125.1° |
| N4 | C26 | C31 | 119.8° | 120.1° |
| N4 | C26 | C27 | 120.5° | 120.1° |
| C31 | C26 | C27 | 119.7° | 119.8° |
| C26 | C31 | C30 | 120.3° | 120.0° |
| C26 | C31 | H29 | 119.8° | 120.0° |
| C26 | C27 | C28 | 120.2° | 120.0° |
| C26 | C27 | H26 | 119.9° | 120.0° |
| C31 | C30 | C29 | 119.2° | 120.0° |
| C31 | C30 | H28 | 120.4° | 120.0° |
| C30 | C31 | H29 | 119.9° | 120.0° |
| C27 | C28 | C29 | 119.2° | 120.1° |
| C28 | C27 | H26 | 119.9° | 120.1° |
| C27 | C28 | H27 | 120.4° | 120.0° |
| C30 | C29 | C28 | 121.5° | 120.2° |
| C30 | C29 | BR32 | 119.1° | 119.9° |
| C29 | C30 | H28 | 120.4° | 120.0° |
| C28 | C29 | BR32 | 119.3° | 120.0° |
| C29 | C28 | H27 | 120.4° | 120.0° |
| H1 | C33 | H2 | 109.5° | 109.5° |
| H1 | C33 | H3 | 109.5° | 109.5° |
| H2 | C33 | H3 | 109.5° | 109.4° |
| H5 | C13 | H6 | 109.5° | 109.5° |
| H7 | C21 | H8 | 109.5° | 110.3° |
| H9 | C16 | H10 | 109.5° | 109.5° |
| H11 | C1 | H12 | 109.5° | 109.4° |
| H11 | C1 | H13 | 109.5° | 109.5° |
| H12 | C1 | H13 | 109.5° | 109.4° |
| H14 | C12 | H15 | 109.5° | 109.5° |
| H17 | C15 | H18 | 109.5° | 109.6° |
| H20 | C22 | H21 | 109.5° | 110.9° |
| H22 | C23 | H23 | 109.5° | 110.8° |
| H24 | C24 | H25 | 109.4° | 110.0° |
| H30 | N25 | H31 | 109.4° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | C23 | C22 | H22 | 119.0° | 118.3° |
| C24 | C23 | C22 | H23 | 119.0° | 118.4° |
| C23 | C24 | N20 | H24 | 118.9° | 119.4° |
| C23 | C24 | N20 | H25 | 119.0° | 119.4° |
| C24 | C23 | C22 | C21 | 39.7° | 35.5° |
| C23 | C24 | N20 | C21 | 19.7° | 1.1° |
| C23 | C24 | N20 | C18 | 161.1° | 178.9° |
| C24 | C23 | C22 | H20 | 79.3° | 82.5° |
| C24 | C23 | C22 | H21 | 158.8° | 153.6° |
| C24 | C23 | H22 | H23 | 122.9° | 123.3° |
| C23 | C24 | H24 | H25 | 123.1° | 121.1° |
| C22 | C23 | C24 | N20 | 36.3° | 22.2° |
| C23 | C22 | C21 | H20 | 119.0° | 118.1° |
| C23 | C22 | C21 | H21 | 119.1° | 118.1° |
| C23 | C22 | C21 | N20 | 27.2° | 37.1° |
| C23 | C22 | C21 | H7 | 146.3° | 81.8° |
| C23 | C22 | C21 | H8 | 91.8° | 156.0° |
| C23 | C22 | H20 | H21 | 122.8° | 123.9° |
| C22 | C23 | H22 | H23 | 122.9° | 123.2° |
| C22 | C23 | C24 | H24 | 155.3° | 97.2° |
| C22 | C23 | C24 | H25 | 82.6° | 141.6° |
| C24 | N20 | C21 | C22 | 4.7° | 24.2° |
| C24 | N20 | C21 | C18 | 179.1° | 180.0° |
| C24 | N20 | C18 | O19 | 0.9° | 0.0° |
| C24 | N20 | C18 | C17 | 178.9° | 180.0° |
| C24 | N20 | C21 | H7 | 123.7° | 94.7° |
| C24 | N20 | C21 | H8 | 114.4° | 143.1° |
| N20 | C24 | C23 | H22 | 155.3° | 140.5° |
| N20 | C24 | C23 | H23 | 82.7° | 96.1° |
| N20 | C24 | H24 | H25 | 123.1° | 121.1° |
| C22 | C21 | N20 | H7 | 119.1° | 118.9° |
| C22 | C21 | N20 | H8 | 119.1° | 118.9° |
| C22 | C21 | N20 | C18 | 174.5° | 155.8° |
| C22 | C21 | H7 | H8 | 122.8° | 122.2° |
| C21 | C22 | H20 | H21 | 122.8° | 123.9° |
| C21 | C22 | C23 | H22 | 158.7° | 153.8° |
| C21 | C22 | C23 | H23 | 79.2° | 82.9° |
| C21 | N20 | C18 | O19 | 178.2° | 180.0° |
| C21 | N20 | C18 | C17 | 0.1° | 0.0° |
| N20 | C21 | H7 | H8 | 122.7° | 122.3° |
| N20 | C21 | C22 | H20 | 91.8° | 81.0° |
| N20 | C21 | C22 | H21 | 146.3° | 155.2° |
| C21 | N20 | C24 | H24 | 138.7° | 120.5° |
| C21 | N20 | C24 | H25 | 99.2° | 118.3° |
| N20 | C18 | O19 | C17 | 178.0° | 180.0° |
| N20 | C18 | C17 | N25 | 114.8° | 160.0° |
| N20 | C18 | C17 | C14 | 120.8° | 80.0° |
| C18 | N20 | C21 | H7 | 55.4° | 85.3° |
| C18 | N20 | C21 | H8 | 66.4° | 36.9° |
| N20 | C18 | C17 | H19 | 1.9° | 40.0° |
| C18 | N20 | C24 | H24 | 42.1° | 59.5° |
| C18 | N20 | C24 | H25 | 80.0° | 61.7° |
| O19 | C18 | C17 | N25 | 67.1° | 20.0° |
| O19 | C18 | C17 | C14 | 57.3° | 100.0° |
| O19 | C18 | C17 | H19 | 176.2° | 140.0° |
| C18 | C17 | N25 | C14 | 124.6° | 120.0° |
| C18 | C17 | N25 | H19 | 116.3° | 120.0° |
| C18 | C17 | C14 | H19 | 119.0° | 119.9° |
| C18 | C17 | C14 | C15 | 42.7° | 180.0° |
| C18 | C17 | C14 | C13 | 166.0° | 60.4° |
| C18 | C17 | C14 | H16 | 75.3° | 59.8° |
| C18 | C17 | N25 | H30 | 180.0° | 60.0° |
| C18 | C17 | N25 | H31 | 60.0° | 176.0° |
| N25 | C17 | C14 | H19 | 119.5° | 120.0° |
| N25 | C17 | C14 | C15 | 164.2° | 60.0° |
| N25 | C17 | C14 | C13 | 72.5° | 59.7° |
| N25 | C17 | C14 | H16 | 46.2° | 179.8° |
| C17 | N25 | H30 | H31 | 120.0° | 124.0° |
| C17 | C14 | C15 | C13 | 125.5° | 119.9° |
| C17 | C14 | C15 | H16 | 117.9° | 120.2° |
| C17 | C14 | C13 | H16 | 118.6° | 120.2° |
| C17 | C14 | C15 | C16 | 178.5° | 177.6° |
| C17 | C14 | C13 | C12 | 178.8° | 177.5° |
| C17 | C14 | C13 | H5 | 61.2° | 62.5° |
| C17 | C14 | C13 | H6 | 58.9° | 57.6° |
| C17 | C14 | C15 | H17 | 58.5° | 57.6° |
| C17 | C14 | C15 | H18 | 61.4° | 62.5° |
| C14 | C17 | N25 | H30 | 55.4° | 60.0° |
| C14 | C17 | N25 | H31 | 175.4° | 64.0° |
| C15 | C14 | C13 | H16 | 116.6° | 119.9° |
| C14 | C15 | C16 | H17 | 120.0° | 119.9° |
| C14 | C15 | C16 | H18 | 120.0° | 119.9° |
| C15 | C14 | C13 | C12 | 56.3° | 57.6° |
| C14 | C15 | C16 | N11 | 58.2° | 59.2° |
| C15 | C14 | C13 | H5 | 63.6° | 177.6° |
| C15 | C14 | C13 | H6 | 176.2° | 62.3° |
| C14 | C15 | C16 | H9 | 62.3° | 60.8° |
| C14 | C15 | C16 | H10 | 178.7° | 179.2° |
| C14 | C15 | H17 | H18 | 119.9° | 120.1° |
| C15 | C14 | C17 | H19 | 76.3° | 60.0° |
| C13 | C14 | C15 | C16 | 56.0° | 57.6° |
| C14 | C13 | C12 | H5 | 119.9° | 120.0° |
| C14 | C13 | C12 | H6 | 119.9° | 120.0° |
| C14 | C13 | C12 | N11 | 59.3° | 59.2° |
| C14 | C13 | H5 | H6 | 120.2° | 120.1° |
| C14 | C13 | C12 | H14 | 179.7° | 179.2° |
| C14 | C13 | C12 | H15 | 61.1° | 60.8° |
| C13 | C14 | C15 | H17 | 176.0° | 62.3° |
| C13 | C14 | C15 | H18 | 64.0° | 177.6° |
| C13 | C14 | C17 | H19 | 47.0° | 179.7° |
| C15 | C16 | N11 | H9 | 120.5° | 120.0° |
| C15 | C16 | N11 | H10 | 120.5° | 119.9° |
| C15 | C16 | N11 | C12 | 58.9° | 61.8° |
| C15 | C16 | N11 | C7 | 161.0° | 174.2° |
| C15 | C16 | H9 | H10 | 118.6° | 120.0° |
| C16 | C15 | C14 | H16 | 60.6° | 62.3° |
| C16 | C15 | H17 | H18 | 119.9° | 120.1° |
| C13 | C12 | N11 | C16 | 59.5° | 61.7° |
| C13 | C12 | N11 | H14 | 120.4° | 120.0° |
| C13 | C12 | N11 | H15 | 120.4° | 120.0° |
| C13 | C12 | N11 | C7 | 161.2° | 174.2° |
| C12 | C13 | H5 | H6 | 120.2° | 120.0° |
| C13 | C12 | H14 | H15 | 118.8° | 120.0° |
| C12 | C13 | C14 | H16 | 60.3° | 62.3° |
| C16 | N11 | C12 | C7 | 139.3° | 124.1° |
| C16 | N11 | C7 | N8 | 106.0° | 61.4° |
| C16 | N11 | C7 | C6 | 72.1° | 118.2° |
| N11 | C16 | H9 | H10 | 118.6° | 120.0° |
| C16 | N11 | C12 | H14 | 179.9° | 178.3° |
| C16 | N11 | C12 | H15 | 60.9° | 58.2° |
| N11 | C16 | C15 | H17 | 178.2° | 60.7° |
| N11 | C16 | C15 | H18 | 61.8° | 179.1° |
| C12 | N11 | C7 | N8 | 30.0° | 62.8° |
| C12 | N11 | C7 | C6 | 152.0° | 117.6° |
| N11 | C12 | C13 | H5 | 60.7° | 179.2° |
| N11 | C12 | C13 | H6 | 179.2° | 60.8° |
| C12 | N11 | C16 | H9 | 61.6° | 58.3° |
| C12 | N11 | C16 | H10 | 179.3° | 178.3° |
| N11 | C12 | H14 | H15 | 118.8° | 120.0° |
| N11 | C7 | N8 | C6 | 178.0° | 179.6° |
| N11 | C7 | C6 | C2 | 4.6° | 0.4° |
| N11 | C7 | N8 | C9 | 177.1° | 179.7° |
| N11 | C7 | C6 | C5 | 175.2° | 179.7° |
| C7 | N11 | C16 | H9 | 78.6° | 65.8° |
| C7 | N11 | C16 | H10 | 40.5° | 54.2° |
| C7 | N11 | C12 | H14 | 40.8° | 54.2° |
| C7 | N11 | C12 | H15 | 78.4° | 65.8° |
| C1 | C2 | C6 | C7 | 2.3° | 0.0° |
| C1 | C2 | C6 | C3 | 178.1° | 179.9° |
| C1 | C2 | C6 | C5 | 177.9° | 179.9° |
| C1 | C2 | C3 | C33 | 0.4° | 0.1° |
| C1 | C2 | C3 | N4 | 178.3° | 179.9° |
| C2 | C1 | H11 | H12 | 120.0° | 120.0° |
| C2 | C1 | H11 | H13 | 120.0° | 120.1° |
| C2 | C1 | H12 | H13 | 120.0° | 120.0° |
| N8 | C7 | C6 | C2 | 177.4° | 180.0° |
| N8 | C7 | C6 | C5 | 2.7° | 0.1° |
| C7 | N8 | C9 | N10 | 1.1° | 0.0° |
| C7 | N8 | C9 | H4 | 178.9° | 180.0° |
| C7 | C6 | C2 | C5 | 179.8° | 179.9° |
| C7 | C6 | C2 | C3 | 179.6° | 179.9° |
| C6 | C7 | N8 | C9 | 0.9° | 0.1° |
| C7 | C6 | C5 | N4 | 179.3° | 180.0° |
| C7 | C6 | C5 | N10 | 3.0° | 0.0° |
| C6 | C2 | C3 | C33 | 178.6° | 180.0° |
| C6 | C2 | C3 | N4 | 0.1° | 0.0° |
| C2 | C6 | C5 | N4 | 0.6° | 0.0° |
| C2 | C6 | C5 | N10 | 177.1° | 180.0° |
| C6 | C2 | C1 | H11 | 88.9° | 95.1° |
| C6 | C2 | C1 | H12 | 151.1° | 144.9° |
| C6 | C2 | C1 | H13 | 31.1° | 25.0° |
| C3 | C2 | C6 | C5 | 0.3° | 0.0° |
| C2 | C3 | C33 | N4 | 178.6° | 180.0° |
| C2 | C3 | N4 | C5 | 0.5° | 0.0° |
| C2 | C3 | N4 | C26 | 173.8° | 180.0° |
| C2 | C3 | C33 | H1 | 89.2° | 90.0° |
| C2 | C3 | C33 | H2 | 150.8° | 150.0° |
| C2 | C3 | C33 | H3 | 30.8° | 30.0° |
| C3 | C2 | C1 | H11 | 88.9° | 84.8° |
| C3 | C2 | C1 | H12 | 31.1° | 35.1° |
| C3 | C2 | C1 | H13 | 151.1° | 155.1° |
| N8 | C9 | N10 | H4 | 180.0° | 180.0° |
| N8 | C9 | N10 | C5 | 0.9° | 0.0° |
| C6 | C5 | N4 | C3 | 0.7° | 0.0° |
| C6 | C5 | N10 | C9 | 1.3° | 0.0° |
| C6 | C5 | N4 | N10 | 177.7° | 180.0° |
| C6 | C5 | N4 | C26 | 173.8° | 180.0° |
| C33 | C3 | N4 | C5 | 178.3° | 180.0° |
| C33 | C3 | N4 | C26 | 7.4° | 0.0° |
| C3 | C33 | H1 | H2 | 120.0° | 120.0° |
| C3 | C33 | H1 | H3 | 120.0° | 120.0° |
| C3 | C33 | H2 | H3 | 120.0° | 120.0° |
| C3 | N4 | C5 | C26 | 174.4° | 180.0° |
| C3 | N4 | C5 | N10 | 177.0° | 180.0° |
| C3 | N4 | C26 | C31 | 111.8° | 115.0° |
| C3 | N4 | C26 | C27 | 70.3° | 64.8° |
| N4 | C3 | C33 | H1 | 89.4° | 90.0° |
| N4 | C3 | C33 | H2 | 30.6° | 30.0° |
| N4 | C3 | C33 | H3 | 150.6° | 150.0° |
| C9 | N10 | C5 | N4 | 178.5° | 180.0° |
| C5 | N4 | C26 | C31 | 61.7° | 65.0° |
| C5 | N4 | C26 | C27 | 116.3° | 115.2° |
| N10 | C5 | N4 | C26 | 8.6° | 0.0° |
| C5 | N10 | C9 | H4 | 179.0° | 180.0° |
| N4 | C26 | C31 | C27 | 177.9° | 179.8° |
| N4 | C26 | C31 | C30 | 177.9° | 179.8° |
| N4 | C26 | C27 | C28 | 177.9° | 179.7° |
| N4 | C26 | C27 | H26 | 2.2° | 0.2° |
| N4 | C26 | C31 | H29 | 2.2° | 0.2° |
| C26 | C31 | C30 | H29 | 180.0° | 180.0° |
| C31 | C26 | C27 | C28 | 0.0° | 0.1° |
| C26 | C31 | C30 | C29 | 0.0° | 0.0° |
| C31 | C26 | C27 | H26 | 179.9° | 180.0° |
| C26 | C31 | C30 | H28 | 180.0° | 180.0° |
| C27 | C26 | C31 | C30 | 0.1° | 0.0° |
| C26 | C27 | C28 | H26 | 180.0° | 179.9° |
| C26 | C27 | C28 | C29 | 0.0° | 0.1° |
| C26 | C27 | C28 | H27 | 180.0° | 180.0° |
| C27 | C26 | C31 | H29 | 179.9° | 180.0° |
| C31 | C30 | C29 | H28 | 180.0° | 180.0° |
| C31 | C30 | C29 | C28 | 0.1° | 0.0° |
| C31 | C30 | C29 | BR32 | 178.7° | 180.0° |
| C27 | C28 | C29 | C30 | 0.1° | 0.0° |
| C27 | C28 | C29 | H27 | 180.0° | 179.9° |
| C27 | C28 | C29 | BR32 | 178.7° | 180.0° |
| C30 | C29 | C28 | BR32 | 178.8° | 180.0° |
| C30 | C29 | C28 | H27 | 179.9° | 180.0° |
| C29 | C30 | C31 | H29 | 180.0° | 180.0° |
| C29 | C28 | C27 | H26 | 180.0° | 180.0° |
| C28 | C29 | C30 | H28 | 179.9° | 180.0° |
| BR32 | C29 | C28 | H27 | 1.3° | 0.0° |
| BR32 | C29 | C30 | H28 | 1.3° | 0.0° |
| H1 | C33 | H2 | H3 | 120.0° | 120.0° |
| H5 | C13 | C12 | H14 | 59.7° | 60.8° |
| H5 | C13 | C12 | H15 | 178.9° | 59.2° |
| H5 | C13 | C14 | H16 | 179.8° | 57.7° |
| H6 | C13 | C12 | H14 | 60.4° | 59.2° |
| H6 | C13 | C12 | H15 | 58.8° | 179.2° |
| H6 | C13 | C14 | H16 | 59.6° | 177.8° |
| H7 | C21 | C22 | H20 | 27.2° | 160.1° |
| H7 | C21 | C22 | H21 | 94.7° | 36.2° |
| H8 | C21 | C22 | H20 | 149.1° | 37.9° |
| H8 | C21 | C22 | H21 | 27.2° | 86.0° |
| H9 | C16 | C15 | H17 | 57.8° | 179.3° |
| H9 | C16 | C15 | H18 | 177.7° | 59.1° |
| H10 | C16 | C15 | H17 | 61.3° | 59.3° |
| H10 | C16 | C15 | H18 | 58.6° | 60.9° |
| H11 | C1 | H12 | H13 | 120.0° | 119.9° |
| H16 | C14 | C15 | H17 | 59.4° | 177.8° |
| H16 | C14 | C15 | H18 | 179.4° | 57.7° |
| H16 | C14 | C17 | H19 | 165.7° | 60.1° |
| H19 | C17 | N25 | H30 | 63.7° | 179.9° |
| H19 | C17 | N25 | H31 | 56.3° | 56.0° |
| H20 | C22 | C23 | H22 | 39.7° | 35.8° |
| H20 | C22 | C23 | H23 | 161.7° | 159.1° |
| H21 | C22 | C23 | H22 | 82.2° | 88.1° |
| H21 | C22 | C23 | H23 | 39.8° | 35.2° |
| H22 | C23 | C24 | H24 | 85.7° | 21.1° |
| H22 | C23 | C24 | H25 | 36.4° | 100.1° |
| H23 | C23 | C24 | H24 | 36.3° | 144.4° |
| H23 | C23 | C24 | H25 | 158.4° | 23.3° |
| H26 | C27 | C28 | H27 | 0.0° | 0.1° |
| H28 | C30 | C31 | H29 | 0.0° | 0.0° |
