A1I1C
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C12 | C13 | sing | 1.53Å | 1.50Å | |
| C12 | C11 | sing | 1.53Å | 1.50Å | |
| C13 | C11 | sing | 1.53Å | 1.50Å | |
| C11 | C10 | sing | 1.51Å | 1.50Å | |
| C10 | N9 | sing | 1.33Å | 1.37Å | Aromatic |
| C10 | N14 | doub | 1.31Å | 1.31Å | Aromatic |
| N9 | C8 | doub | 1.31Å | 1.31Å | Aromatic |
| N14 | N7 | sing | 1.41Å | 1.37Å | Aromatic |
| C8 | N7 | sing | 1.34Å | 1.33Å | Aromatic |
| N7 | C6 | sing | 1.46Å | 1.46Å | |
| C15 | C6 | sing | 1.54Å | 1.55Å | |
| C15 | C4 | sing | 1.53Å | 1.55Å | |
| C6 | C5 | sing | 1.54Å | 1.55Å | |
| N27 | C26 | doub | 1.32Å | 1.34Å | Aromatic |
| N27 | C28 | sing | 1.32Å | 1.33Å | Aromatic |
| C5 | C4 | sing | 1.53Å | 1.54Å | |
| C26 | C25 | sing | 1.40Å | 1.40Å | Aromatic |
| C28 | C29 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | C16 | sing | 1.53Å | 1.54Å | |
| C4 | C3 | sing | 1.53Å | 1.54Å | |
| C16 | N2 | sing | 1.48Å | 1.47Å | |
| C25 | C24 | sing | 1.48Å | 1.46Å | |
| C25 | C30 | doub | 1.40Å | 1.40Å | Aromatic |
| C29 | C30 | sing | 1.38Å | 1.39Å | Aromatic |
| O36 | C24 | sing | 1.35Å | 1.33Å | Aromatic |
| O36 | C19 | sing | 1.35Å | 1.37Å | Aromatic |
| C3 | N2 | sing | 1.48Å | 1.47Å | |
| C24 | N23 | doub | 1.31Å | 1.29Å | Aromatic |
| N2 | C1 | sing | 1.35Å | 1.33Å | |
| C30 | C31 | sing | 1.51Å | 1.52Å | |
| C19 | C18 | doub | 1.38Å | 1.36Å | Aromatic |
| C19 | C20 | sing | 1.41Å | 1.38Å | Aromatic |
| C18 | C17 | sing | 1.40Å | 1.39Å | Aromatic |
| N23 | C20 | sing | 1.35Å | 1.39Å | Aromatic |
| C20 | C21 | doub | 1.40Å | 1.39Å | Aromatic |
| C17 | C1 | sing | 1.48Å | 1.49Å | |
| C17 | C22 | doub | 1.40Å | 1.41Å | Aromatic |
| C1 | O37 | doub | 1.22Å | 1.22Å | |
| C31 | C32 | sing | 1.54Å | 1.53Å | |
| C31 | C35 | sing | 1.54Å | 1.54Å | |
| C32 | C33 | sing | 1.54Å | 1.53Å | |
| C21 | C22 | sing | 1.36Å | 1.39Å | Aromatic |
| C35 | C34 | sing | 1.55Å | 1.51Å | |
| C33 | C34 | sing | 1.55Å | 1.53Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.08Å | 1.08Å | |
| C22 | H10 | sing | 1.08Å | 1.08Å | |
| C26 | H11 | sing | 1.08Å | 1.08Å | |
| C28 | H12 | sing | 1.08Å | 1.08Å | |
| C11 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C29 | H19 | sing | 1.08Å | 1.08Å | |
| C3 | H20 | sing | 1.09Å | 1.10Å | |
| C3 | H21 | sing | 1.09Å | 1.10Å | |
| C31 | H22 | sing | 1.09Å | 1.10Å | |
| C32 | H23 | sing | 1.09Å | 1.10Å | |
| C32 | H24 | sing | 1.09Å | 1.10Å | |
| C33 | H25 | sing | 1.09Å | 1.10Å | |
| C33 | H26 | sing | 1.09Å | 1.10Å | |
| C34 | H27 | sing | 1.09Å | 1.10Å | |
| C34 | H28 | sing | 1.09Å | 1.10Å | |
| C35 | H29 | sing | 1.09Å | 1.10Å | |
| C35 | H30 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C12 | C11 | 60.1° | 60.0° |
| C12 | C13 | C11 | 60.0° | 60.0° |
| C12 | C13 | H5 | 120.0° | 117.5° |
| C12 | C13 | H6 | 120.0° | 117.6° |
| C13 | C12 | H14 | 120.0° | 117.5° |
| C13 | C12 | H15 | 120.0° | 117.4° |
| C12 | C11 | C13 | 59.9° | 60.0° |
| C12 | C11 | C10 | 117.3° | 117.5° |
| C12 | C11 | H13 | 116.1° | 117.5° |
| C11 | C12 | H14 | 120.0° | 117.5° |
| C11 | C12 | H15 | 120.0° | 117.5° |
| C13 | C11 | C10 | 119.5° | 117.5° |
| C11 | C13 | H5 | 120.0° | 117.5° |
| C11 | C13 | H6 | 120.0° | 117.5° |
| C13 | C11 | H13 | 116.1° | 117.5° |
| C11 | C10 | N9 | 122.9° | 125.5° |
| C11 | C10 | N14 | 122.0° | 125.5° |
| C10 | C11 | H13 | 116.2° | 115.5° |
| N9 | C10 | N14 | 115.1° | 109.0° |
| C10 | N9 | C8 | 102.5° | 109.8° |
| C10 | N14 | N7 | 101.9° | 106.8° |
| N9 | C8 | N7 | 110.5° | 108.1° |
| N9 | C8 | H4 | 124.8° | 125.9° |
| N14 | N7 | C8 | 110.1° | 106.3° |
| N14 | N7 | C6 | 121.2° | 126.8° |
| C8 | N7 | C6 | 128.8° | 126.9° |
| N7 | C8 | H4 | 124.8° | 126.0° |
| N7 | C6 | C15 | 122.7° | 113.6° |
| N7 | C6 | C5 | 115.1° | 113.6° |
| N7 | C6 | H3 | 110.8° | 112.8° |
| C6 | C15 | C4 | 86.5° | 86.7° |
| C15 | C6 | C5 | 86.5° | 87.3° |
| C15 | C6 | H3 | 109.7° | 113.6° |
| C6 | C15 | H7 | 114.9° | 113.7° |
| C6 | C15 | H8 | 114.8° | 113.6° |
| C15 | C4 | C5 | 86.6° | 88.2° |
| C15 | C4 | C16 | 122.9° | 121.3° |
| C15 | C4 | C3 | 120.3° | 121.3° |
| C4 | C15 | H7 | 114.9° | 113.7° |
| C4 | C15 | H8 | 114.9° | 113.7° |
| C6 | C5 | C4 | 86.6° | 86.8° |
| C6 | C5 | H1 | 114.9° | 113.7° |
| C6 | C5 | H2 | 114.9° | 113.8° |
| C5 | C6 | H3 | 109.6° | 113.6° |
| C26 | N27 | C28 | 117.0° | 121.9° |
| N27 | C26 | C25 | 124.4° | 120.6° |
| N27 | C26 | H11 | 117.8° | 119.8° |
| N27 | C28 | C29 | 123.5° | 121.1° |
| N27 | C28 | H12 | 118.2° | 119.4° |
| C5 | C4 | C16 | 123.9° | 121.3° |
| C5 | C4 | C3 | 116.0° | 121.3° |
| C4 | C5 | H1 | 114.9° | 113.7° |
| C4 | C5 | H2 | 114.8° | 113.7° |
| C26 | C25 | C24 | 118.0° | 120.6° |
| C26 | C25 | C30 | 117.5° | 118.9° |
| C25 | C26 | H11 | 117.8° | 119.7° |
| C28 | C29 | C30 | 119.6° | 119.3° |
| C29 | C28 | H12 | 118.2° | 119.5° |
| C28 | C29 | H19 | 120.2° | 120.3° |
| C16 | C4 | C3 | 90.5° | 87.4° |
| C4 | C16 | N2 | 86.6° | 85.8° |
| C4 | C16 | H16 | 114.8° | 113.8° |
| C4 | C16 | H17 | 114.8° | 113.9° |
| C4 | C3 | N2 | 86.7° | 85.7° |
| C4 | C3 | H20 | 114.8° | 113.8° |
| C4 | C3 | H21 | 114.8° | 113.9° |
| C16 | N2 | C3 | 96.2° | 91.3° |
| C16 | N2 | C1 | 139.8° | 134.3° |
| N2 | C16 | H16 | 114.9° | 113.8° |
| N2 | C16 | H17 | 114.9° | 113.8° |
| C24 | C25 | C30 | 124.4° | 120.6° |
| C25 | C24 | O36 | 118.3° | 125.0° |
| C25 | C24 | N23 | 124.2° | 125.0° |
| C25 | C30 | C29 | 118.0° | 118.3° |
| C25 | C30 | C31 | 123.9° | 120.9° |
| C29 | C30 | C31 | 118.1° | 120.8° |
| C30 | C29 | H19 | 120.2° | 120.4° |
| C24 | O36 | C19 | 103.1° | 108.1° |
| O36 | C24 | N23 | 117.5° | 110.1° |
| O36 | C19 | C18 | 128.2° | 133.8° |
| O36 | C19 | C20 | 108.0° | 106.4° |
| C3 | N2 | C1 | 123.7° | 134.4° |
| N2 | C3 | H20 | 114.8° | 113.8° |
| N2 | C3 | H21 | 114.8° | 113.8° |
| C24 | N23 | C20 | 103.2° | 108.8° |
| N2 | C1 | C17 | 118.7° | 119.9° |
| N2 | C1 | O37 | 121.8° | 120.0° |
| C30 | C31 | C32 | 113.7° | 110.0° |
| C30 | C31 | C35 | 109.9° | 110.1° |
| C30 | C31 | H22 | 109.9° | 110.0° |
| C18 | C19 | C20 | 123.8° | 119.9° |
| C19 | C18 | C17 | 117.7° | 119.7° |
| C19 | C18 | H18 | 121.2° | 120.2° |
| C19 | C20 | N23 | 108.2° | 106.7° |
| C19 | C20 | C21 | 119.1° | 119.9° |
| C18 | C17 | C1 | 119.2° | 120.0° |
| C18 | C17 | C22 | 119.8° | 120.1° |
| C17 | C18 | H18 | 121.2° | 120.1° |
| N23 | C20 | C21 | 132.6° | 133.5° |
| C20 | C21 | C22 | 118.4° | 120.0° |
| C20 | C21 | H9 | 120.8° | 120.0° |
| C1 | C17 | C22 | 121.0° | 119.9° |
| C17 | C1 | O37 | 119.5° | 120.1° |
| C17 | C22 | C21 | 121.2° | 120.4° |
| C17 | C22 | H10 | 119.4° | 119.8° |
| C32 | C31 | C35 | 104.0° | 106.6° |
| C31 | C32 | C33 | 105.6° | 106.6° |
| C32 | C31 | H22 | 109.7° | 110.0° |
| C31 | C32 | H23 | 110.5° | 110.0° |
| C31 | C32 | H24 | 110.4° | 110.0° |
| C31 | C35 | C34 | 104.8° | 104.2° |
| C35 | C31 | H22 | 109.6° | 110.1° |
| C31 | C35 | H29 | 110.6° | 110.5° |
| C31 | C35 | H30 | 110.6° | 110.5° |
| C32 | C33 | C34 | 107.4° | 104.2° |
| C33 | C32 | H23 | 110.4° | 110.0° |
| C33 | C32 | H24 | 110.4° | 110.1° |
| C32 | C33 | H25 | 110.0° | 110.5° |
| C32 | C33 | H26 | 110.0° | 110.5° |
| C22 | C21 | H9 | 120.8° | 120.0° |
| C21 | C22 | H10 | 119.4° | 119.8° |
| C35 | C34 | C33 | 106.5° | 102.8° |
| C35 | C34 | H27 | 110.2° | 110.7° |
| C35 | C34 | H28 | 110.2° | 110.9° |
| C34 | C35 | H29 | 110.6° | 110.5° |
| C34 | C35 | H30 | 110.6° | 110.5° |
| C34 | C33 | H25 | 110.0° | 110.5° |
| C34 | C33 | H26 | 110.0° | 110.4° |
| C33 | C34 | H27 | 110.2° | 110.7° |
| C33 | C34 | H28 | 110.2° | 110.8° |
| H1 | C5 | H2 | 109.5° | 112.8° |
| H5 | C13 | H6 | 109.5° | 115.5° |
| H7 | C15 | H8 | 109.5° | 112.9° |
| H14 | C12 | H15 | 109.5° | 115.6° |
| H16 | C16 | H17 | 109.5° | 113.1° |
| H20 | C3 | H21 | 109.5° | 113.1° |
| H23 | C32 | H24 | 109.4° | 110.1° |
| H25 | C33 | H26 | 109.5° | 110.6° |
| H27 | C34 | H28 | 109.5° | 110.7° |
| H29 | C35 | H30 | 109.5° | 110.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C12 | C11 | H14 | 109.5° | 107.5° |
| C13 | C12 | C11 | H15 | 109.5° | 107.4° |
| C12 | C13 | C11 | H5 | 109.5° | 107.5° |
| C12 | C13 | C11 | H6 | 109.4° | 107.6° |
| C13 | C12 | C11 | C10 | 110.0° | 107.5° |
| C12 | C13 | H5 | H6 | 144.7° | 145.7° |
| C13 | C12 | C11 | H13 | 106.4° | 107.5° |
| C13 | C12 | H14 | H15 | 144.7° | 145.6° |
| C12 | C11 | C10 | H13 | 143.6° | 145.6° |
| C12 | C11 | C10 | N9 | 15.9° | 8.6° |
| C12 | C11 | C10 | N14 | 164.3° | 171.0° |
| C11 | C12 | H14 | H15 | 144.7° | 145.8° |
| C13 | C11 | C10 | H13 | 147.2° | 145.7° |
| C13 | C11 | C10 | N9 | 85.1° | 60.0° |
| C13 | C11 | C10 | N14 | 95.1° | 120.4° |
| C11 | C13 | H5 | H6 | 144.7° | 145.7° |
| C11 | C10 | N9 | N14 | 179.8° | 179.7° |
| C11 | C10 | N9 | C8 | 179.9° | 180.0° |
| C11 | C10 | N14 | N7 | 179.9° | 179.9° |
| C10 | C11 | C13 | H5 | 3.2° | 145.0° |
| C10 | C11 | C13 | H6 | 144.3° | 0.1° |
| C10 | C11 | C12 | H14 | 140.5° | 145.0° |
| C10 | C11 | C12 | H15 | 0.5° | 0.1° |
| N9 | C10 | N14 | N7 | 0.0° | 0.5° |
| C10 | N9 | C8 | N7 | 0.0° | 0.0° |
| C10 | N9 | C8 | H4 | 179.9° | 179.8° |
| N9 | C10 | C11 | H13 | 127.7° | 154.3° |
| N14 | C10 | N9 | C8 | 0.0° | 0.3° |
| C10 | N14 | N7 | C8 | 0.0° | 0.4° |
| C10 | N14 | N7 | C6 | 179.8° | 179.6° |
| N14 | C10 | C11 | H13 | 52.1° | 25.4° |
| N9 | C8 | N7 | N14 | 0.0° | 0.3° |
| N9 | C8 | N7 | H4 | 180.0° | 179.8° |
| N9 | C8 | N7 | C6 | 179.8° | 179.8° |
| N14 | N7 | C8 | C6 | 179.8° | 179.9° |
| N14 | N7 | C6 | C15 | 52.7° | 167.3° |
| N14 | N7 | C6 | C5 | 50.1° | 94.9° |
| N14 | N7 | C6 | H3 | 175.1° | 36.2° |
| N14 | N7 | C8 | H4 | 180.0° | 180.0° |
| C8 | N7 | C6 | C15 | 127.6° | 12.8° |
| C8 | N7 | C6 | C5 | 129.7° | 85.0° |
| C8 | N7 | C6 | H3 | 4.6° | 143.9° |
| N7 | C6 | C15 | C5 | 117.7° | 114.6° |
| N7 | C6 | C15 | H3 | 132.6° | 130.8° |
| N7 | C6 | C15 | C4 | 145.3° | 90.0° |
| N7 | C6 | C5 | H3 | 125.7° | 130.8° |
| N7 | C6 | C5 | C4 | 152.3° | 90.0° |
| N7 | C6 | C5 | H1 | 91.8° | 24.5° |
| N7 | C6 | C5 | H2 | 36.4° | 155.5° |
| C6 | N7 | C8 | H4 | 0.2° | 0.0° |
| N7 | C6 | C15 | H7 | 29.4° | 155.5° |
| N7 | C6 | C15 | H8 | 98.9° | 24.5° |
| C6 | C15 | C4 | H7 | 115.8° | 114.4° |
| C6 | C15 | C4 | H8 | 115.8° | 114.4° |
| C15 | C6 | C5 | H3 | 109.7° | 114.6° |
| C6 | C15 | C4 | C5 | 27.6° | 24.8° |
| C6 | C15 | C4 | C16 | 156.4° | 101.3° |
| C6 | C15 | C4 | C3 | 90.6° | 150.9° |
| C15 | C6 | C5 | H1 | 143.5° | 139.1° |
| C15 | C6 | C5 | H2 | 88.3° | 89.9° |
| C6 | C15 | H7 | H8 | 131.0° | 131.4° |
| C15 | C4 | C5 | C16 | 128.0° | 126.1° |
| C15 | C4 | C5 | C3 | 122.2° | 126.0° |
| C15 | C4 | C16 | C3 | 127.3° | 125.5° |
| C15 | C4 | C16 | N2 | 128.6° | 148.5° |
| C15 | C4 | C3 | N2 | 130.6° | 148.5° |
| C15 | C4 | C5 | H1 | 143.5° | 139.3° |
| C15 | C4 | C5 | H2 | 88.3° | 89.8° |
| C4 | C15 | C6 | H3 | 82.1° | 139.3° |
| C4 | C15 | H7 | H8 | 131.0° | 131.5° |
| C15 | C4 | C16 | H16 | 115.5° | 97.3° |
| C15 | C4 | C16 | H17 | 12.7° | 34.3° |
| C15 | C4 | C3 | H20 | 14.7° | 34.3° |
| C15 | C4 | C3 | H21 | 113.5° | 97.3° |
| C6 | C5 | C4 | H1 | 115.9° | 114.5° |
| C6 | C5 | C4 | H2 | 115.9° | 114.6° |
| C6 | C5 | C4 | C16 | 155.5° | 101.2° |
| C6 | C5 | C4 | C3 | 94.6° | 150.9° |
| C6 | C5 | H1 | H2 | 130.9° | 131.5° |
| C5 | C6 | C15 | H7 | 88.3° | 89.9° |
| C5 | C6 | C15 | H8 | 143.4° | 139.1° |
| N27 | C26 | C25 | H11 | 180.0° | 179.7° |
| C26 | N27 | C28 | C29 | 0.0° | 0.5° |
| N27 | C26 | C25 | C24 | 179.6° | 179.8° |
| N27 | C26 | C25 | C30 | 0.7° | 0.2° |
| C26 | N27 | C28 | H12 | 180.0° | 179.7° |
| C28 | N27 | C26 | C25 | 0.4° | 0.0° |
| N27 | C28 | C29 | H12 | 180.0° | 179.2° |
| N27 | C28 | C29 | C30 | 0.0° | 0.7° |
| C28 | N27 | C26 | H11 | 179.6° | 179.7° |
| N27 | C28 | C29 | H19 | 180.0° | 179.2° |
| C5 | C4 | C16 | C3 | 122.3° | 125.5° |
| C5 | C4 | C16 | N2 | 121.0° | 102.5° |
| C5 | C4 | C3 | N2 | 127.4° | 102.5° |
| C4 | C5 | H1 | H2 | 130.9° | 131.3° |
| C4 | C5 | C6 | H3 | 82.1° | 139.2° |
| C5 | C4 | C15 | H7 | 88.2° | 89.6° |
| C5 | C4 | C15 | H8 | 143.4° | 139.3° |
| C5 | C4 | C16 | H16 | 5.1° | 11.7° |
| C5 | C4 | C16 | H17 | 123.1° | 143.3° |
| C5 | C4 | C3 | H20 | 116.7° | 143.3° |
| C5 | C4 | C3 | H21 | 11.5° | 11.7° |
| C26 | C25 | C24 | C30 | 178.8° | 180.0° |
| C26 | C25 | C30 | C29 | 0.7° | 0.0° |
| C26 | C25 | C24 | O36 | 27.0° | 47.9° |
| C26 | C25 | C24 | N23 | 153.1° | 132.1° |
| C26 | C25 | C30 | C31 | 179.6° | 180.0° |
| C28 | C29 | C30 | C25 | 0.4° | 0.4° |
| C28 | C29 | C30 | H19 | 180.0° | 179.9° |
| C28 | C29 | C30 | C31 | 179.9° | 179.6° |
| C4 | C16 | N2 | H16 | 115.8° | 114.2° |
| C4 | C16 | N2 | H17 | 115.8° | 114.2° |
| C16 | C4 | C3 | N2 | 1.3° | 23.0° |
| C4 | C16 | N2 | C1 | 171.7° | 156.1° |
| C16 | C4 | C5 | H1 | 88.6° | 13.2° |
| C16 | C4 | C5 | H2 | 39.7° | 144.2° |
| C16 | C4 | C15 | H7 | 40.5° | 144.3° |
| C16 | C4 | C15 | H8 | 87.8° | 13.2° |
| C4 | C16 | H16 | H17 | 130.9° | 132.0° |
| C16 | C4 | C3 | H20 | 114.6° | 91.2° |
| C16 | C4 | C3 | H21 | 117.1° | 137.2° |
| C4 | C3 | N2 | H20 | 115.9° | 114.2° |
| C4 | C3 | N2 | H21 | 115.9° | 114.2° |
| C4 | C3 | N2 | C1 | 173.3° | 156.1° |
| C3 | C4 | C5 | H1 | 21.3° | 94.7° |
| C3 | C4 | C5 | H2 | 149.5° | 36.2° |
| C3 | C4 | C15 | H7 | 153.5° | 36.5° |
| C3 | C4 | C15 | H8 | 25.2° | 94.7° |
| C3 | C4 | C16 | H16 | 117.1° | 137.3° |
| C3 | C4 | C16 | H17 | 114.6° | 91.2° |
| C4 | C3 | H20 | H21 | 130.9° | 132.0° |
| C16 | N2 | C3 | C1 | 174.6° | 180.0° |
| C16 | N2 | C1 | C17 | 6.0° | 175.0° |
| C16 | N2 | C1 | O37 | 173.4° | 5.1° |
| N2 | C16 | H16 | H17 | 131.0° | 131.9° |
| C16 | N2 | C3 | H20 | 114.6° | 90.3° |
| C16 | N2 | C3 | H21 | 117.2° | 138.1° |
| C24 | C25 | C30 | C29 | 179.5° | 180.0° |
| C25 | C24 | O36 | N23 | 179.9° | 180.0° |
| C25 | C24 | O36 | C19 | 179.8° | 180.0° |
| C24 | C25 | C30 | C31 | 0.8° | 0.0° |
| C25 | C24 | N23 | C20 | 179.8° | 180.0° |
| C24 | C25 | C26 | H11 | 0.4° | 0.1° |
| C25 | C30 | C29 | C31 | 179.8° | 180.0° |
| C30 | C25 | C24 | O36 | 151.8° | 132.1° |
| C30 | C25 | C24 | N23 | 28.1° | 47.9° |
| C25 | C30 | C31 | C32 | 151.7° | 123.5° |
| C25 | C30 | C31 | C35 | 92.3° | 119.3° |
| C30 | C25 | C26 | H11 | 179.3° | 180.0° |
| C25 | C30 | C29 | H19 | 179.7° | 179.5° |
| C25 | C30 | C31 | H22 | 28.4° | 2.2° |
| C29 | C30 | C31 | C32 | 28.0° | 56.5° |
| C29 | C30 | C31 | C35 | 88.0° | 60.7° |
| C30 | C29 | C28 | H12 | 180.0° | 179.9° |
| C29 | C30 | C31 | H22 | 151.4° | 177.8° |
| C24 | O36 | C19 | C18 | 180.0° | 180.0° |
| C24 | O36 | C19 | C20 | 0.0° | 0.0° |
| O36 | C24 | N23 | C20 | 0.1° | 0.0° |
| C19 | O36 | C24 | N23 | 0.1° | 0.0° |
| O36 | C19 | C18 | C20 | 180.0° | 180.0° |
| O36 | C19 | C18 | C17 | 180.0° | 180.0° |
| O36 | C19 | C20 | N23 | 0.0° | 0.0° |
| O36 | C19 | C20 | C21 | 179.9° | 179.7° |
| O36 | C19 | C18 | H18 | 0.0° | 0.1° |
| C3 | N2 | C1 | C17 | 177.7° | 5.0° |
| C3 | N2 | C1 | O37 | 1.7° | 174.9° |
| C3 | N2 | C16 | H16 | 117.2° | 138.1° |
| C3 | N2 | C16 | H17 | 114.5° | 90.4° |
| N2 | C3 | H20 | H21 | 130.9° | 131.9° |
| C24 | N23 | C20 | C19 | 0.0° | 0.0° |
| C24 | N23 | C20 | C21 | 180.0° | 179.7° |
| N2 | C1 | C17 | C18 | 57.1° | 6.3° |
| N2 | C1 | C17 | O37 | 179.4° | 179.9° |
| N2 | C1 | C17 | C22 | 123.1° | 173.5° |
| C1 | N2 | C16 | H16 | 55.9° | 41.9° |
| C1 | N2 | C16 | H17 | 72.4° | 89.7° |
| C1 | N2 | C3 | H20 | 70.8° | 89.7° |
| C1 | N2 | C3 | H21 | 57.4° | 41.9° |
| C30 | C31 | C32 | C35 | 119.4° | 119.3° |
| C30 | C31 | C32 | H22 | 123.5° | 121.3° |
| C30 | C31 | C35 | H22 | 120.8° | 121.4° |
| C30 | C31 | C32 | C33 | 148.9° | 119.3° |
| C30 | C31 | C35 | C34 | 156.7° | 142.9° |
| C31 | C30 | C29 | H19 | 0.1° | 0.5° |
| C30 | C31 | C32 | H23 | 91.7° | 121.4° |
| C30 | C31 | C32 | H24 | 29.5° | 0.0° |
| C30 | C31 | C35 | H29 | 37.4° | 24.2° |
| C30 | C31 | C35 | H30 | 84.1° | 98.4° |
| C19 | C18 | C17 | H18 | 180.0° | 179.9° |
| C18 | C19 | C20 | N23 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.0° | 0.3° |
| C19 | C18 | C17 | C1 | 179.9° | 179.9° |
| C19 | C18 | C17 | C22 | 0.0° | 0.3° |
| C20 | C19 | C18 | C17 | 0.0° | 0.0° |
| C19 | C20 | N23 | C21 | 179.9° | 179.7° |
| C19 | C20 | C21 | C22 | 0.1° | 0.3° |
| C19 | C20 | C21 | H9 | 179.9° | 180.0° |
| C20 | C19 | C18 | H18 | 180.0° | 180.0° |
| C18 | C17 | C1 | C22 | 179.9° | 179.8° |
| C18 | C17 | C1 | O37 | 123.6° | 173.8° |
| C18 | C17 | C22 | C21 | 0.0° | 0.3° |
| C18 | C17 | C22 | H10 | 180.0° | 179.8° |
| N23 | C20 | C21 | C22 | 180.0° | 180.0° |
| N23 | C20 | C21 | H9 | 0.0° | 0.4° |
| C20 | C21 | C22 | C17 | 0.0° | 0.0° |
| C20 | C21 | C22 | H9 | 180.0° | 179.7° |
| C20 | C21 | C22 | H10 | 180.0° | 179.9° |
| C1 | C17 | C22 | C21 | 179.9° | 180.0° |
| C1 | C17 | C22 | H10 | 0.1° | 0.0° |
| C1 | C17 | C18 | H18 | 0.1° | 0.0° |
| C22 | C17 | C1 | O37 | 56.3° | 6.4° |
| C17 | C22 | C21 | H10 | 180.0° | 180.0° |
| C17 | C22 | C21 | H9 | 179.9° | 179.7° |
| C22 | C17 | C18 | H18 | 180.0° | 179.8° |
| C32 | C31 | C35 | H22 | 117.2° | 119.3° |
| C31 | C32 | C33 | H23 | 119.4° | 119.2° |
| C31 | C32 | C33 | H24 | 119.4° | 119.2° |
| C32 | C31 | C35 | C34 | 34.7° | 23.6° |
| C31 | C32 | C33 | C34 | 13.5° | 23.6° |
| C31 | C32 | H23 | H24 | 121.8° | 121.4° |
| C31 | C32 | C33 | H25 | 106.2° | 142.2° |
| C31 | C32 | C33 | H26 | 133.1° | 95.1° |
| C32 | C31 | C35 | H29 | 84.5° | 95.1° |
| C32 | C31 | C35 | H30 | 154.0° | 142.3° |
| C35 | C31 | C32 | C33 | 29.5° | 0.0° |
| C31 | C35 | C34 | H29 | 119.2° | 118.7° |
| C31 | C35 | C34 | H30 | 119.2° | 118.7° |
| C31 | C35 | C34 | C33 | 26.6° | 37.9° |
| C35 | C31 | C32 | H23 | 148.9° | 119.3° |
| C35 | C31 | C32 | H24 | 89.9° | 119.3° |
| C31 | C35 | C34 | H27 | 146.1° | 80.4° |
| C31 | C35 | C34 | H28 | 93.0° | 156.4° |
| C31 | C35 | H29 | H30 | 122.1° | 122.6° |
| C32 | C33 | C34 | C35 | 8.3° | 37.9° |
| C32 | C33 | C34 | H25 | 119.7° | 118.7° |
| C32 | C33 | C34 | H26 | 119.7° | 118.6° |
| C33 | C32 | C31 | H22 | 87.6° | 119.3° |
| C33 | C32 | H23 | H24 | 121.8° | 121.5° |
| C32 | C33 | H25 | H26 | 121.0° | 122.6° |
| C32 | C33 | C34 | H27 | 127.8° | 80.4° |
| C32 | C33 | C34 | H28 | 111.3° | 156.4° |
| C35 | C34 | C33 | H27 | 119.6° | 118.3° |
| C35 | C34 | C33 | H28 | 119.5° | 118.5° |
| C34 | C35 | C31 | H22 | 82.5° | 95.7° |
| C35 | C34 | C33 | H25 | 127.9° | 156.6° |
| C35 | C34 | C33 | H26 | 111.4° | 80.7° |
| C35 | C34 | H27 | H28 | 121.4° | 123.4° |
| C34 | C35 | H29 | H30 | 122.2° | 122.6° |
| C34 | C33 | C32 | H23 | 132.9° | 95.7° |
| C34 | C33 | C32 | H24 | 105.9° | 142.8° |
| C34 | C33 | H25 | H26 | 120.9° | 122.6° |
| C33 | C34 | H27 | H28 | 121.4° | 123.2° |
| C33 | C34 | C35 | H29 | 92.7° | 80.8° |
| C33 | C34 | C35 | H30 | 145.8° | 156.6° |
| H1 | C5 | C6 | H3 | 33.8° | 106.3° |
| H2 | C5 | C6 | H3 | 162.1° | 24.7° |
| H3 | C6 | C15 | H7 | 162.1° | 24.8° |
| H3 | C6 | C15 | H8 | 33.7° | 106.3° |
| H5 | C13 | C11 | H13 | 144.1° | 0.0° |
| H5 | C13 | C12 | H14 | 141.0° | 0.0° |
| H5 | C13 | C12 | H15 | 0.0° | 145.0° |
| H6 | C13 | C11 | H13 | 3.0° | 145.0° |
| H6 | C13 | C12 | H14 | 0.0° | 145.0° |
| H6 | C13 | C12 | H15 | 141.1° | 0.0° |
| H9 | C21 | C22 | H10 | 0.1° | 0.3° |
| H12 | C28 | C29 | H19 | 0.0° | 0.0° |
| H13 | C11 | C12 | H14 | 3.1° | 0.0° |
| H13 | C11 | C12 | H15 | 144.1° | 145.0° |
| H22 | C31 | C32 | H23 | 31.8° | 0.1° |
| H22 | C31 | C32 | H24 | 153.0° | 121.4° |
| H22 | C31 | C35 | H29 | 158.3° | 145.6° |
| H22 | C31 | C35 | H30 | 36.8° | 23.0° |
| H23 | C32 | C33 | H25 | 13.2° | 23.0° |
| H23 | C32 | C33 | H26 | 107.5° | 145.7° |
| H24 | C32 | C33 | H25 | 134.4° | 98.5° |
| H24 | C32 | C33 | H26 | 13.7° | 24.2° |
| H25 | C33 | C34 | H27 | 112.5° | 38.3° |
| H25 | C33 | C34 | H28 | 8.4° | 84.9° |
| H26 | C33 | C34 | H27 | 8.1° | 161.0° |
| H26 | C33 | C34 | H28 | 129.0° | 37.8° |
| H27 | C34 | C35 | H29 | 26.9° | 160.9° |
| H27 | C34 | C35 | H30 | 94.7° | 38.3° |
| H28 | C34 | C35 | H29 | 147.8° | 37.6° |
| H28 | C34 | C35 | H30 | 26.3° | 85.0° |
