X2B
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C60 | C59 | doub | 1.38Å | 1.39Å | Aromatic |
| C60 | C56 | sing | 1.39Å | 1.40Å | Aromatic |
| C64 | C63 | doub | 1.38Å | 1.41Å | Aromatic |
| C64 | C65 | sing | 1.37Å | 1.40Å | Aromatic |
| C59 | N58 | sing | 1.33Å | 1.35Å | Aromatic |
| C63 | C54 | sing | 1.39Å | 1.37Å | Aromatic |
| C65 | C66 | doub | 1.37Å | 1.40Å | Aromatic |
| N47 | C48 | sing | 1.35Å | 1.48Å | |
| N47 | C46 | sing | 1.46Å | 1.49Å | |
| C36 | C35 | doub | 1.38Å | 1.41Å | Aromatic |
| C36 | C33 | sing | 1.37Å | 1.41Å | Aromatic |
| C50 | C49 | sing | 1.56Å | 1.54Å | |
| C50 | C56 | sing | 1.51Å | 1.55Å | |
| C49 | C48 | sing | 1.53Å | 1.54Å | |
| C49 | N52 | sing | 1.48Å | 1.45Å | |
| C56 | C61 | doub | 1.39Å | 1.39Å | Aromatic |
| N58 | C57 | doub | 1.33Å | 1.35Å | Aromatic |
| C35 | C32 | sing | 1.39Å | 1.41Å | Aromatic |
| C48 | O51 | doub | 1.24Å | 1.20Å | |
| C46 | C33 | sing | 1.52Å | 1.54Å | |
| C20 | C16 | doub | 1.37Å | 1.40Å | Aromatic |
| C20 | C17 | sing | 1.38Å | 1.42Å | Aromatic |
| C33 | C37 | doub | 1.40Å | 1.41Å | Aromatic |
| C54 | C53 | sing | 1.51Å | 1.50Å | |
| C54 | C62 | doub | 1.39Å | 1.38Å | Aromatic |
| C66 | C62 | sing | 1.39Å | 1.37Å | Aromatic |
| C16 | C19 | sing | 1.37Å | 1.41Å | Aromatic |
| C57 | C61 | sing | 1.38Å | 1.40Å | Aromatic |
| N52 | C53 | sing | 1.35Å | 1.47Å | |
| C30 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| C30 | C29 | sing | 1.40Å | 1.41Å | Aromatic |
| C17 | C15 | doub | 1.40Å | 1.43Å | Aromatic |
| C53 | O55 | doub | 1.23Å | 1.20Å | |
| C32 | C29 | sing | 1.49Å | 1.49Å | |
| C32 | N34 | doub | 1.35Å | 1.34Å | Aromatic |
| C27 | C31 | sing | 1.37Å | 1.40Å | Aromatic |
| C37 | N34 | sing | 1.34Å | 1.36Å | Aromatic |
| C29 | N14 | doub | 1.34Å | 1.37Å | Aromatic |
| C19 | C18 | doub | 1.40Å | 1.43Å | Aromatic |
| N34 | IR07 | sing | 2.20Å | 2.08Å | |
| C15 | C18 | sing | 1.38Å | 1.42Å | Aromatic |
| C15 | IR07 | sing | 2.06Å | 2.13Å | |
| C31 | C28 | doub | 1.38Å | 1.41Å | Aromatic |
| C18 | C21 | sing | 1.45Å | 1.45Å | |
| N14 | C28 | sing | 1.36Å | 1.36Å | Aromatic |
| N14 | IR07 | sing | 2.18Å | 2.09Å | |
| IR07 | C03 | sing | 2.09Å | 2.07Å | |
| IR07 | N10 | sing | 2.42Å | 2.08Å | |
| IR07 | N23 | sing | 2.44Å | 2.05Å | |
| C01 | C03 | doub | 1.39Å | 1.43Å | Aromatic |
| C01 | C04 | sing | 1.37Å | 1.40Å | Aromatic |
| C03 | C06 | sing | 1.37Å | 1.42Å | Aromatic |
| C04 | C05 | doub | 1.37Å | 1.41Å | Aromatic |
| C21 | N23 | doub | 1.30Å | 1.33Å | Aromatic |
| C21 | C24 | sing | 1.42Å | 1.40Å | Aromatic |
| C38 | C39 | doub | 1.36Å | 1.40Å | Aromatic |
| C38 | C13 | sing | 1.41Å | 1.40Å | Aromatic |
| N10 | C13 | doub | 1.37Å | 1.38Å | Aromatic |
| N10 | C08 | sing | 1.32Å | 1.35Å | Aromatic |
| C39 | C40 | sing | 1.40Å | 1.40Å | Aromatic |
| C13 | C09 | sing | 1.42Å | 1.41Å | Aromatic |
| C06 | C08 | sing | 1.47Å | 1.50Å | |
| C06 | C02 | doub | 1.41Å | 1.43Å | Aromatic |
| C05 | C02 | sing | 1.38Å | 1.41Å | Aromatic |
| C08 | C11 | doub | 1.42Å | 1.41Å | Aromatic |
| N23 | C26 | sing | 1.36Å | 1.35Å | Aromatic |
| C40 | C41 | doub | 1.36Å | 1.40Å | Aromatic |
| C09 | C41 | sing | 1.41Å | 1.42Å | Aromatic |
| C09 | C12 | doub | 1.40Å | 1.40Å | Aromatic |
| C24 | C25 | doub | 1.36Å | 1.41Å | Aromatic |
| C11 | C12 | sing | 1.35Å | 1.41Å | Aromatic |
| C26 | C42 | doub | 1.41Å | 1.41Å | Aromatic |
| C26 | C22 | sing | 1.42Å | 1.39Å | Aromatic |
| C25 | C22 | sing | 1.41Å | 1.41Å | Aromatic |
| C42 | C43 | sing | 1.36Å | 1.39Å | Aromatic |
| C22 | C45 | doub | 1.41Å | 1.41Å | Aromatic |
| C43 | C44 | doub | 1.40Å | 1.40Å | Aromatic |
| C45 | C44 | sing | 1.36Å | 1.41Å | Aromatic |
| C01 | H1 | sing | 0.94Å | 1.08Å | |
| C02 | H2 | sing | 0.94Å | 1.08Å | |
| C04 | H3 | sing | 0.94Å | 1.08Å | |
| C05 | H4 | sing | 0.94Å | 1.08Å | |
| C11 | H5 | sing | 0.94Å | 1.08Å | |
| C12 | H6 | sing | 0.94Å | 1.08Å | |
| C16 | H7 | sing | 0.94Å | 1.08Å | |
| C17 | H8 | sing | 0.93Å | 1.08Å | |
| C19 | H9 | sing | 0.94Å | 1.08Å | |
| C20 | H10 | sing | 0.94Å | 1.08Å | |
| C24 | H11 | sing | 0.94Å | 1.08Å | |
| C25 | H12 | sing | 0.94Å | 1.08Å | |
| C27 | H13 | sing | 0.94Å | 1.08Å | |
| C28 | H14 | sing | 0.94Å | 1.08Å | |
| C30 | H15 | sing | 0.94Å | 1.08Å | |
| C31 | H16 | sing | 0.94Å | 1.08Å | |
| C35 | H17 | sing | 0.94Å | 1.08Å | |
| C36 | H18 | sing | 0.94Å | 1.08Å | |
| C37 | H19 | sing | 0.94Å | 1.08Å | |
| C38 | H20 | sing | 0.93Å | 1.08Å | |
| C39 | H21 | sing | 0.94Å | 1.08Å | |
| C40 | H22 | sing | 0.94Å | 1.08Å | |
| C41 | H23 | sing | 0.94Å | 1.08Å | |
| C42 | H24 | sing | 0.94Å | 1.08Å | |
| C43 | H25 | sing | 0.94Å | 1.08Å | |
| C44 | H26 | sing | 0.94Å | 1.08Å | |
| C45 | H27 | sing | 0.94Å | 1.08Å | |
| C46 | H28 | sing | 0.98Å | 1.10Å | |
| C46 | H29 | sing | 0.98Å | 1.10Å | |
| C49 | H30 | sing | 0.99Å | 1.10Å | |
| C50 | H31 | sing | 0.98Å | 1.10Å | |
| C50 | H32 | sing | 0.98Å | 1.10Å | |
| C57 | H33 | sing | 0.94Å | 1.08Å | |
| C59 | H34 | sing | 0.94Å | 1.08Å | |
| C60 | H35 | sing | 0.94Å | 1.08Å | |
| C61 | H36 | sing | 0.94Å | 1.08Å | |
| C62 | H37 | sing | 0.94Å | 1.08Å | |
| C63 | H38 | sing | 0.94Å | 1.08Å | |
| C64 | H39 | sing | 0.94Å | 1.08Å | |
| C65 | H40 | sing | 0.94Å | 1.08Å | |
| C66 | H41 | sing | 0.94Å | 1.08Å | |
| N47 | H42 | sing | 0.88Å | 1.00Å | |
| N52 | H43 | sing | 0.88Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C59 | C60 | C56 | 120.5° | 120.1° |
| C60 | C59 | N58 | 120.5° | 123.7° |
| C60 | C59 | H34 | 119.8° | 118.4° |
| C59 | C60 | H35 | 119.7° | 119.9° |
| C60 | C56 | C50 | 119.5° | 120.2° |
| C60 | C56 | C61 | 118.3° | 116.0° |
| C56 | C60 | H35 | 119.8° | 119.9° |
| C63 | C64 | C65 | 120.8° | 120.2° |
| C64 | C63 | C54 | 116.7° | 120.7° |
| C64 | C63 | H38 | 121.7° | 119.4° |
| C63 | C64 | H39 | 119.6° | 119.8° |
| C64 | C65 | C66 | 120.7° | 119.8° |
| C65 | C64 | H39 | 119.6° | 120.0° |
| C64 | C65 | H40 | 119.7° | 120.0° |
| C59 | N58 | C57 | 119.9° | 116.5° |
| N58 | C59 | H34 | 119.7° | 118.0° |
| C63 | C54 | C53 | 115.7° | 122.4° |
| C63 | C54 | C62 | 123.1° | 118.3° |
| C54 | C63 | H38 | 121.6° | 119.9° |
| C65 | C66 | C62 | 118.5° | 120.3° |
| C66 | C65 | H40 | 119.7° | 120.1° |
| C65 | C66 | H41 | 120.8° | 119.9° |
| C48 | N47 | C46 | 124.1° | 123.5° |
| N47 | C48 | C49 | 132.1° | 119.4° |
| N47 | C48 | O51 | 115.5° | 122.9° |
| C48 | N47 | H42 | 117.9° | 121.0° |
| N47 | C46 | C33 | 110.2° | 115.4° |
| N47 | C46 | H28 | 109.3° | 108.6° |
| N47 | C46 | H29 | 109.3° | 108.2° |
| C46 | N47 | H42 | 117.9° | 115.3° |
| C35 | C36 | C33 | 115.7° | 120.4° |
| C36 | C35 | C32 | 122.1° | 119.5° |
| C36 | C35 | H17 | 119.0° | 119.6° |
| C35 | C36 | H18 | 122.2° | 119.7° |
| C36 | C33 | C46 | 121.9° | 120.5° |
| C36 | C33 | C37 | 118.8° | 116.6° |
| C33 | C36 | H18 | 122.1° | 119.9° |
| C49 | C50 | C56 | 114.6° | 123.8° |
| C50 | C49 | C48 | 118.7° | 106.8° |
| C50 | C49 | N52 | 97.9° | 113.5° |
| C50 | C49 | H30 | 112.8° | 109.7° |
| C49 | C50 | H31 | 108.2° | 107.2° |
| C49 | C50 | H32 | 108.2° | 106.5° |
| C50 | C56 | C61 | 122.2° | 123.7° |
| C56 | C50 | H31 | 108.2° | 106.3° |
| C56 | C50 | H32 | 108.2° | 107.2° |
| C48 | C49 | N52 | 98.5° | 109.2° |
| C49 | C48 | O51 | 112.4° | 117.7° |
| C48 | C49 | H30 | 112.8° | 107.3° |
| C49 | N52 | C53 | 133.5° | 128.3° |
| N52 | C49 | H30 | 114.3° | 110.0° |
| C49 | N52 | H43 | 113.3° | 116.3° |
| C56 | C61 | C57 | 118.8° | 119.8° |
| C56 | C61 | H36 | 120.6° | 120.5° |
| N58 | C57 | C61 | 122.0° | 123.8° |
| N58 | C57 | H33 | 119.0° | 117.9° |
| C35 | C32 | C29 | 126.1° | 122.1° |
| C35 | C32 | N34 | 121.5° | 121.8° |
| C32 | C35 | H17 | 119.0° | 120.9° |
| C46 | C33 | C37 | 119.2° | 122.8° |
| C33 | C46 | H28 | 109.3° | 108.3° |
| C33 | C46 | H29 | 109.3° | 108.7° |
| C16 | C20 | C17 | 121.8° | 121.1° |
| C20 | C16 | C19 | 116.3° | 118.1° |
| C20 | C16 | H7 | 121.9° | 121.5° |
| C16 | C20 | H10 | 119.1° | 118.7° |
| C20 | C17 | C15 | 123.8° | 123.7° |
| C20 | C17 | H8 | 118.1° | 116.0° |
| C17 | C20 | H10 | 119.1° | 120.2° |
| C33 | C37 | N34 | 124.9° | 124.9° |
| C33 | C37 | H19 | 117.5° | 117.7° |
| C53 | C54 | C62 | 121.2° | 119.1° |
| C54 | C53 | N52 | 142.4° | 116.7° |
| C54 | C53 | O55 | 103.4° | 120.1° |
| C54 | C62 | C66 | 120.3° | 120.6° |
| C54 | C62 | H37 | 119.9° | 119.8° |
| C66 | C62 | H37 | 119.8° | 119.6° |
| C62 | C66 | H41 | 120.8° | 119.8° |
| C16 | C19 | C18 | 121.1° | 119.1° |
| C19 | C16 | H7 | 121.8° | 120.4° |
| C16 | C19 | H9 | 119.5° | 119.5° |
| C61 | C57 | H33 | 119.0° | 118.2° |
| C57 | C61 | H36 | 120.6° | 119.7° |
| N52 | C53 | O55 | 114.1° | 122.4° |
| C53 | N52 | H43 | 113.2° | 115.2° |
| C27 | C30 | C29 | 120.8° | 119.6° |
| C30 | C27 | C31 | 115.7° | 119.4° |
| C30 | C27 | H13 | 122.1° | 120.2° |
| C27 | C30 | H15 | 119.6° | 119.6° |
| C30 | C29 | C32 | 123.0° | 123.7° |
| C30 | C29 | N14 | 122.9° | 121.6° |
| C29 | C30 | H15 | 119.6° | 120.8° |
| C17 | C15 | C18 | 112.5° | 112.3° |
| C17 | C15 | IR07 | 125.3° | 124.2° |
| C15 | C17 | H8 | 118.1° | 120.3° |
| C29 | C32 | N34 | 112.3° | 116.0° |
| C32 | C29 | N14 | 114.1° | 114.7° |
| C32 | N34 | C37 | 116.7° | 116.8° |
| C32 | N34 | IR07 | 120.0° | 112.3° |
| C27 | C31 | C28 | 121.0° | 118.1° |
| C31 | C27 | H13 | 122.1° | 120.4° |
| C27 | C31 | H16 | 119.5° | 121.1° |
| C37 | N34 | IR07 | 122.8° | 125.7° |
| N34 | C37 | H19 | 117.5° | 117.4° |
| C29 | N14 | C28 | 116.2° | 117.2° |
| C29 | N14 | IR07 | 117.7° | 116.1° |
| C19 | C18 | C15 | 124.2° | 125.6° |
| C19 | C18 | C21 | 126.2° | 120.6° |
| C18 | C19 | H9 | 119.5° | 121.4° |
| N34 | IR07 | C15 | 83.8° | 99.6° |
| N34 | IR07 | N14 | 75.6° | 75.4° |
| N34 | IR07 | C03 | 94.4° | 120.2° |
| N34 | IR07 | N10 | 71.9° | 77.3° |
| N34 | IR07 | N23 | 148.6° | 122.5° |
| C18 | C15 | IR07 | 121.4° | 110.8° |
| C15 | C18 | C21 | 109.5° | 113.6° |
| C15 | IR07 | N14 | 76.4° | 131.7° |
| C15 | IR07 | C03 | 92.6° | 85.1° |
| C15 | IR07 | N10 | 153.9° | 145.8° |
| C15 | IR07 | N23 | 70.5° | 60.7° |
| C31 | C28 | N14 | 123.3° | 124.1° |
| C31 | C28 | H14 | 118.3° | 118.2° |
| C28 | C31 | H16 | 119.5° | 120.9° |
| C18 | C21 | N23 | 111.4° | 101.0° |
| C18 | C21 | C24 | 125.9° | 135.6° |
| C28 | N14 | IR07 | 125.9° | 126.1° |
| N14 | C28 | H14 | 118.3° | 117.7° |
| N14 | IR07 | C03 | 165.8° | 139.6° |
| N14 | IR07 | N10 | 105.6° | 81.1° |
| N14 | IR07 | N23 | 80.9° | 81.3° |
| C03 | IR07 | N10 | 80.2° | 68.3° |
| C03 | IR07 | N23 | 104.3° | 111.7° |
| IR07 | C03 | C01 | 125.9° | 131.6° |
| IR07 | C03 | C06 | 113.8° | 101.7° |
| N10 | IR07 | N23 | 135.6° | 148.6° |
| IR07 | N10 | C13 | 126.5° | 129.8° |
| IR07 | N10 | C08 | 115.9° | 90.8° |
| IR07 | N23 | C21 | 126.9° | 100.3° |
| IR07 | N23 | C26 | 115.1° | 124.3° |
| C03 | C01 | C04 | 119.9° | 123.3° |
| C01 | C03 | C06 | 120.3° | 116.1° |
| C03 | C01 | H1 | 120.1° | 118.8° |
| C01 | C04 | C05 | 121.1° | 119.4° |
| C04 | C01 | H1 | 120.0° | 117.0° |
| C01 | C04 | H3 | 119.4° | 120.4° |
| C03 | C06 | C08 | 114.5° | 113.7° |
| C03 | C06 | C02 | 118.2° | 121.2° |
| C04 | C05 | C02 | 118.9° | 119.0° |
| C05 | C04 | H3 | 119.4° | 120.2° |
| C04 | C05 | H4 | 120.6° | 120.7° |
| N23 | C21 | C24 | 122.6° | 123.0° |
| C21 | N23 | C26 | 117.9° | 117.6° |
| C21 | C24 | C25 | 119.3° | 118.3° |
| C21 | C24 | H11 | 120.3° | 120.4° |
| C39 | C38 | C13 | 125.9° | 121.1° |
| C38 | C39 | C40 | 119.9° | 120.9° |
| C39 | C38 | H20 | 117.0° | 119.7° |
| C38 | C39 | H21 | 120.0° | 119.4° |
| C38 | C13 | N10 | 122.7° | 120.0° |
| C38 | C13 | C09 | 112.8° | 117.7° |
| C13 | C38 | H20 | 117.0° | 119.3° |
| C13 | N10 | C08 | 116.5° | 116.9° |
| N10 | C13 | C09 | 124.4° | 122.2° |
| N10 | C08 | C06 | 115.3° | 112.7° |
| N10 | C08 | C11 | 121.3° | 123.5° |
| C39 | C40 | C41 | 116.2° | 120.1° |
| C40 | C39 | H21 | 120.0° | 119.7° |
| C39 | C40 | H22 | 121.9° | 119.9° |
| C13 | C09 | C41 | 122.9° | 119.9° |
| C13 | C09 | C12 | 118.5° | 118.4° |
| C08 | C06 | C02 | 127.3° | 124.4° |
| C06 | C08 | C11 | 123.3° | 123.8° |
| C06 | C02 | C05 | 121.6° | 120.3° |
| C06 | C02 | H2 | 119.2° | 121.0° |
| C05 | C02 | H2 | 119.2° | 118.6° |
| C02 | C05 | H4 | 120.6° | 120.3° |
| C08 | C11 | C12 | 122.2° | 119.4° |
| C08 | C11 | H5 | 118.9° | 120.0° |
| N23 | C26 | C42 | 118.5° | 119.8° |
| N23 | C26 | C22 | 124.5° | 120.8° |
| C40 | C41 | C09 | 122.2° | 120.3° |
| C41 | C40 | H22 | 121.9° | 120.0° |
| C40 | C41 | H23 | 118.9° | 119.6° |
| C41 | C09 | C12 | 118.6° | 121.7° |
| C09 | C41 | H23 | 118.9° | 119.9° |
| C09 | C12 | C11 | 116.6° | 118.9° |
| C09 | C12 | H6 | 121.7° | 120.1° |
| C24 | C25 | C22 | 118.1° | 119.0° |
| C25 | C24 | H11 | 120.3° | 121.2° |
| C24 | C25 | H12 | 120.9° | 120.7° |
| C12 | C11 | H5 | 118.9° | 120.3° |
| C11 | C12 | H6 | 121.7° | 120.8° |
| C42 | C26 | C22 | 117.0° | 119.1° |
| C26 | C42 | C43 | 124.7° | 120.2° |
| C26 | C42 | H24 | 117.6° | 119.7° |
| C26 | C22 | C25 | 117.5° | 118.0° |
| C26 | C22 | C45 | 120.4° | 119.1° |
| C25 | C22 | C45 | 122.1° | 122.9° |
| C22 | C25 | H12 | 121.0° | 120.0° |
| C42 | C43 | C44 | 116.7° | 120.7° |
| C43 | C42 | H24 | 117.7° | 120.1° |
| C42 | C43 | H25 | 121.6° | 119.6° |
| C22 | C45 | C44 | 120.2° | 120.2° |
| C22 | C45 | H27 | 119.9° | 119.7° |
| C43 | C44 | C45 | 120.9° | 120.5° |
| C44 | C43 | H25 | 121.7° | 119.7° |
| C43 | C44 | H26 | 119.5° | 119.7° |
| C45 | C44 | H26 | 119.5° | 119.7° |
| C44 | C45 | H27 | 119.9° | 119.5° |
| H28 | C46 | H29 | 109.4° | 107.4° |
| H31 | C50 | H32 | 109.5° | 104.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C59 | C60 | C56 | H35 | 180.0° | 178.8° |
| C60 | C59 | N58 | H34 | 180.0° | 179.9° |
| C59 | C60 | C56 | C50 | 178.5° | 178.8° |
| C59 | C60 | C56 | C61 | 0.0° | 2.1° |
| C60 | C59 | N58 | C57 | 2.3° | 0.1° |
| C56 | C60 | C59 | N58 | 1.2° | 1.0° |
| C60 | C56 | C50 | C49 | 95.0° | 151.5° |
| C60 | C56 | C50 | C61 | 178.4° | 176.4° |
| C60 | C56 | C61 | C57 | 0.1° | 2.2° |
| C60 | C56 | C50 | H31 | 144.3° | 83.9° |
| C60 | C56 | C50 | H32 | 25.7° | 27.1° |
| C56 | C60 | C59 | H34 | 178.8° | 178.9° |
| C60 | C56 | C61 | H36 | 179.9° | 179.2° |
| C63 | C64 | C65 | H39 | 180.0° | 179.5° |
| C64 | C63 | C54 | H38 | 180.0° | 176.7° |
| C63 | C64 | C65 | C66 | 0.3° | 0.5° |
| C64 | C63 | C54 | C53 | 179.5° | 178.3° |
| C64 | C63 | C54 | C62 | 0.0° | 4.1° |
| C63 | C64 | C65 | H40 | 179.7° | 179.6° |
| C65 | C64 | C63 | C54 | 0.2° | 2.6° |
| C64 | C65 | C66 | H40 | 180.0° | 179.9° |
| C64 | C65 | C66 | C62 | 0.3° | 0.0° |
| C65 | C64 | C63 | H38 | 179.8° | 179.3° |
| C64 | C65 | C66 | H41 | 179.7° | 179.8° |
| C59 | N58 | C57 | C61 | 2.3° | 0.0° |
| C59 | N58 | C57 | H33 | 177.7° | 180.0° |
| N58 | C59 | C60 | H35 | 178.7° | 179.8° |
| C63 | C54 | C53 | C62 | 179.6° | 174.2° |
| C63 | C54 | C62 | C66 | 0.0° | 3.6° |
| C63 | C54 | C53 | N52 | 9.2° | 31.8° |
| C63 | C54 | C53 | O55 | 174.1° | 138.2° |
| C63 | C54 | C62 | H37 | 180.0° | 178.2° |
| C54 | C63 | C64 | H39 | 179.9° | 177.9° |
| C65 | C66 | C62 | C54 | 0.2° | 1.6° |
| C65 | C66 | C62 | H41 | 180.0° | 179.9° |
| C65 | C66 | C62 | H37 | 179.8° | 179.8° |
| C66 | C65 | C64 | H39 | 179.7° | 180.0° |
| C48 | N47 | C46 | H42 | 180.0° | 175.1° |
| N47 | C48 | C49 | C50 | 135.0° | 83.8° |
| N47 | C48 | C49 | O51 | 178.6° | 178.9° |
| N47 | C48 | C49 | N52 | 121.2° | 39.4° |
| C48 | N47 | C46 | C33 | 120.4° | 154.5° |
| C48 | N47 | C46 | H28 | 119.5° | 32.8° |
| C48 | N47 | C46 | H29 | 0.3° | 83.4° |
| N47 | C48 | C49 | H30 | 0.2° | 158.6° |
| N47 | C46 | C33 | C36 | 95.8° | 152.6° |
| C46 | N47 | C48 | C49 | 177.5° | 157.4° |
| C46 | N47 | C48 | O51 | 1.0° | 23.7° |
| N47 | C46 | C33 | H28 | 120.1° | 121.9° |
| N47 | C46 | C33 | H29 | 120.1° | 121.8° |
| N47 | C46 | C33 | C37 | 80.5° | 29.3° |
| N47 | C46 | H28 | H29 | 119.7° | 116.8° |
| C35 | C36 | C33 | H18 | 180.0° | 179.9° |
| C36 | C35 | C32 | H17 | 180.0° | 177.2° |
| C35 | C36 | C33 | C46 | 177.5° | 178.9° |
| C35 | C36 | C33 | C37 | 1.1° | 0.8° |
| C36 | C35 | C32 | C29 | 179.7° | 178.6° |
| C36 | C35 | C32 | N34 | 2.4° | 2.5° |
| C33 | C36 | C35 | C32 | 0.3° | 1.5° |
| C36 | C33 | C46 | C37 | 176.4° | 178.0° |
| C36 | C33 | C37 | N34 | 4.5° | 2.3° |
| C33 | C36 | C35 | H17 | 179.8° | 178.7° |
| C36 | C33 | C37 | H19 | 175.5° | 179.7° |
| C36 | C33 | C46 | H28 | 24.3° | 85.5° |
| C36 | C33 | C46 | H29 | 144.0° | 30.8° |
| C49 | C50 | C56 | H31 | 120.7° | 124.6° |
| C49 | C50 | C56 | H32 | 120.7° | 124.3° |
| C50 | C49 | C48 | N52 | 103.8° | 123.2° |
| C50 | C49 | C48 | H30 | 135.2° | 117.6° |
| C50 | C49 | N52 | H30 | 119.4° | 123.4° |
| C49 | C50 | C56 | C61 | 86.6° | 32.1° |
| C50 | C49 | C48 | O51 | 46.5° | 97.3° |
| C50 | C49 | N52 | C53 | 114.9° | 131.1° |
| C49 | C50 | H31 | H32 | 117.6° | 112.7° |
| C50 | C49 | N52 | H43 | 65.1° | 44.8° |
| C56 | C50 | C49 | C48 | 159.6° | 147.4° |
| C56 | C50 | C49 | N52 | 55.4° | 92.2° |
| C50 | C56 | C61 | C57 | 178.5° | 178.7° |
| C56 | C50 | C49 | H30 | 65.2° | 31.4° |
| C56 | C50 | H31 | H32 | 117.7° | 113.1° |
| C50 | C56 | C60 | H35 | 1.5° | 2.4° |
| C50 | C56 | C61 | H36 | 1.5° | 2.6° |
| C48 | C49 | N52 | H30 | 119.9° | 117.5° |
| C48 | C49 | N52 | C53 | 124.4° | 109.8° |
| C48 | C49 | C50 | H31 | 38.8° | 23.2° |
| C48 | C49 | C50 | H32 | 79.6° | 88.0° |
| C49 | C48 | N47 | H42 | 2.5° | 27.7° |
| C48 | C49 | N52 | H43 | 55.6° | 74.3° |
| N52 | C49 | C48 | O51 | 57.4° | 139.5° |
| C49 | N52 | C53 | C54 | 1.3° | 144.7° |
| C49 | N52 | C53 | H43 | 180.0° | 175.9° |
| C49 | N52 | C53 | O55 | 177.8° | 25.1° |
| N52 | C49 | C50 | H31 | 65.3° | 143.6° |
| N52 | C49 | C50 | H32 | 176.2° | 32.5° |
| C56 | C61 | C57 | N58 | 1.0° | 1.2° |
| C56 | C61 | C57 | H36 | 180.0° | 178.7° |
| C61 | C56 | C50 | H31 | 34.2° | 92.5° |
| C61 | C56 | C50 | H32 | 152.7° | 156.4° |
| C56 | C61 | C57 | H33 | 179.0° | 178.8° |
| C61 | C56 | C60 | H35 | 180.0° | 179.1° |
| N58 | C57 | C61 | H33 | 180.0° | 179.9° |
| C57 | N58 | C59 | H34 | 177.7° | 179.9° |
| N58 | C57 | C61 | H36 | 178.9° | 179.9° |
| C35 | C32 | C29 | C30 | 0.0° | 17.3° |
| C35 | C32 | C29 | N34 | 177.4° | 176.3° |
| C35 | C32 | N34 | C37 | 5.3° | 1.1° |
| C35 | C32 | C29 | N14 | 178.7° | 161.9° |
| C35 | C32 | N34 | IR07 | 177.3° | 156.9° |
| C32 | C35 | C36 | H18 | 179.7° | 178.5° |
| O51 | C48 | C49 | H30 | 178.3° | 20.3° |
| O51 | C48 | N47 | H42 | 179.0° | 151.1° |
| C46 | C33 | C37 | N34 | 179.1° | 179.6° |
| C46 | C33 | C36 | H18 | 2.4° | 1.1° |
| C46 | C33 | C37 | H19 | 1.0° | 1.6° |
| C33 | C46 | H28 | H29 | 119.7° | 117.2° |
| C33 | C46 | N47 | H42 | 59.6° | 30.4° |
| C16 | C20 | C17 | H10 | 180.0° | 178.6° |
| C20 | C16 | C19 | H7 | 180.0° | 179.1° |
| C16 | C20 | C17 | C15 | 3.7° | 2.3° |
| C20 | C16 | C19 | C18 | 0.1° | 1.5° |
| C16 | C20 | C17 | H8 | 176.4° | 180.0° |
| C20 | C16 | C19 | H9 | 179.9° | 179.1° |
| C17 | C20 | C16 | C19 | 0.2° | 1.3° |
| C20 | C17 | C15 | H8 | 180.0° | 177.6° |
| C20 | C17 | C15 | C18 | 6.3° | 0.5° |
| C20 | C17 | C15 | IR07 | 176.4° | 137.6° |
| C17 | C20 | C16 | H7 | 179.7° | 179.7° |
| C33 | C37 | N34 | C32 | 6.5° | 1.3° |
| C33 | C37 | N34 | H19 | 180.0° | 178.0° |
| C33 | C37 | N34 | IR07 | 178.2° | 150.9° |
| C37 | C33 | C36 | H18 | 178.8° | 179.3° |
| C37 | C33 | C46 | H28 | 159.4° | 92.5° |
| C37 | C33 | C46 | H29 | 39.6° | 151.1° |
| C53 | C54 | C62 | C66 | 179.5° | 178.0° |
| C54 | C53 | N52 | O55 | 176.5° | 169.8° |
| C53 | C54 | C62 | H37 | 0.5° | 3.8° |
| C53 | C54 | C63 | H38 | 0.4° | 5.0° |
| C54 | C53 | N52 | H43 | 178.7° | 39.4° |
| C54 | C62 | C66 | H37 | 180.0° | 178.1° |
| C62 | C54 | C53 | N52 | 170.4° | 142.4° |
| C62 | C54 | C53 | O55 | 6.3° | 47.6° |
| C62 | C54 | C63 | H38 | 180.0° | 179.2° |
| C54 | C62 | C66 | H41 | 179.9° | 178.2° |
| C62 | C66 | C65 | H40 | 179.7° | 179.9° |
| C16 | C19 | C18 | H9 | 180.0° | 177.6° |
| C16 | C19 | C18 | C15 | 3.4° | 3.6° |
| C16 | C19 | C18 | C21 | 179.7° | 177.3° |
| C19 | C16 | C20 | H10 | 179.8° | 179.9° |
| C53 | N52 | C49 | H30 | 4.5° | 7.7° |
| C27 | C30 | C29 | H15 | 180.0° | 178.4° |
| C27 | C30 | C29 | C32 | 179.9° | 178.8° |
| C30 | C27 | C31 | H13 | 180.0° | 179.7° |
| C27 | C30 | C29 | N14 | 1.3° | 2.0° |
| C30 | C27 | C31 | C28 | 0.5° | 0.6° |
| C30 | C27 | C31 | H16 | 179.5° | 179.2° |
| C30 | C29 | C32 | N14 | 178.8° | 179.2° |
| C30 | C29 | C32 | N34 | 177.5° | 159.0° |
| C29 | C30 | C27 | C31 | 0.3° | 0.6° |
| C30 | C29 | N14 | C28 | 2.6° | 3.2° |
| C30 | C29 | N14 | IR07 | 178.3° | 175.6° |
| C29 | C30 | C27 | H13 | 179.7° | 179.7° |
| C17 | C15 | C18 | C19 | 6.1° | 2.5° |
| C17 | C15 | IR07 | N34 | 12.2° | 49.2° |
| C17 | C15 | C18 | IR07 | 170.6° | 143.7° |
| C17 | C15 | C18 | C21 | 176.5° | 176.6° |
| C17 | C15 | IR07 | N14 | 88.8° | 128.2° |
| C17 | C15 | IR07 | C03 | 81.9° | 70.6° |
| C17 | C15 | IR07 | N10 | 9.0° | 32.4° |
| C17 | C15 | IR07 | N23 | 173.8° | 171.1° |
| C15 | C17 | C20 | H10 | 176.3° | 179.0° |
| O55 | C53 | N52 | H43 | 2.2° | 150.8° |
| C29 | C32 | N34 | C37 | 177.1° | 177.4° |
| C29 | C32 | N34 | IR07 | 5.1° | 26.7° |
| C32 | C29 | N14 | C28 | 178.6° | 177.5° |
| C32 | C29 | N14 | IR07 | 3.0° | 5.2° |
| C32 | C29 | C30 | H15 | 0.1° | 0.4° |
| C29 | C32 | C35 | H17 | 0.3° | 4.2° |
| C32 | N34 | C37 | IR07 | 171.8° | 152.2° |
| N34 | C32 | C29 | N14 | 1.3° | 21.8° |
| C32 | N34 | IR07 | C15 | 72.4° | 113.0° |
| C32 | N34 | IR07 | N14 | 5.2° | 17.8° |
| C32 | N34 | IR07 | C03 | 164.5° | 157.2° |
| C32 | N34 | IR07 | N10 | 117.3° | 101.8° |
| C32 | N34 | IR07 | N23 | 37.6° | 51.6° |
| N34 | C32 | C35 | H17 | 177.6° | 179.7° |
| C32 | N34 | C37 | H19 | 173.5° | 179.4° |
| C27 | C31 | C28 | H16 | 180.0° | 179.8° |
| C27 | C31 | C28 | N14 | 1.0° | 2.0° |
| C27 | C31 | C28 | H14 | 179.0° | 179.3° |
| C31 | C27 | C30 | H15 | 179.7° | 179.0° |
| C37 | N34 | IR07 | C15 | 99.2° | 40.3° |
| C37 | N34 | IR07 | N14 | 176.7° | 171.1° |
| C37 | N34 | IR07 | C03 | 7.0° | 49.5° |
| C37 | N34 | IR07 | N10 | 71.2° | 104.9° |
| C37 | N34 | IR07 | N23 | 133.9° | 101.6° |
| C29 | N14 | IR07 | N34 | 4.2° | 6.4° |
| C29 | N14 | IR07 | C15 | 82.8° | 83.6° |
| C29 | N14 | C28 | C31 | 2.5° | 3.3° |
| C29 | N14 | C28 | IR07 | 175.3° | 171.5° |
| C29 | N14 | IR07 | C03 | 42.0° | 126.2° |
| C29 | N14 | IR07 | N10 | 70.3° | 85.6° |
| C29 | N14 | IR07 | N23 | 154.7° | 120.5° |
| C29 | N14 | C28 | H14 | 177.5° | 179.4° |
| N14 | C29 | C30 | H15 | 178.7° | 179.6° |
| C19 | C18 | C15 | C21 | 177.4° | 174.1° |
| C19 | C18 | C15 | IR07 | 176.7° | 146.2° |
| C19 | C18 | C21 | N23 | 179.1° | 154.3° |
| C19 | C18 | C21 | C24 | 0.1° | 32.9° |
| C18 | C19 | C16 | H7 | 179.9° | 177.6° |
| N34 | IR07 | C15 | C18 | 157.1° | 172.3° |
| N34 | IR07 | C15 | N14 | 76.6° | 79.0° |
| N34 | IR07 | C15 | C03 | 94.1° | 119.8° |
| N34 | IR07 | C15 | N10 | 21.2° | 81.6° |
| N34 | IR07 | C15 | N23 | 161.6° | 121.9° |
| N34 | IR07 | N14 | C28 | 179.4° | 165.2° |
| N34 | IR07 | N14 | C03 | 46.2° | 119.7° |
| N34 | IR07 | N14 | N10 | 66.1° | 79.1° |
| N34 | IR07 | N14 | N23 | 159.0° | 126.9° |
| N34 | IR07 | C03 | N10 | 70.7° | 59.7° |
| N34 | IR07 | C03 | N23 | 154.5° | 154.1° |
| N34 | IR07 | N10 | N23 | 161.6° | 133.5° |
| N34 | IR07 | C03 | C01 | 105.4° | 135.1° |
| N34 | IR07 | C03 | C06 | 72.5° | 6.5° |
| N34 | IR07 | N23 | C21 | 34.5° | 146.7° |
| N34 | IR07 | N10 | C13 | 89.4° | 55.6° |
| N34 | IR07 | N10 | C08 | 102.6° | 71.3° |
| N34 | IR07 | N23 | C26 | 146.9° | 79.4° |
| IR07 | N34 | C37 | H19 | 1.7° | 27.1° |
| C18 | C15 | IR07 | N14 | 80.5° | 93.3° |
| C18 | C15 | IR07 | C03 | 108.8° | 67.9° |
| C18 | C15 | IR07 | N10 | 178.3° | 106.1° |
| C18 | C15 | IR07 | N23 | 4.5° | 50.3° |
| C15 | C18 | C21 | N23 | 3.6° | 20.2° |
| C15 | C18 | C21 | C24 | 177.2° | 152.7° |
| C18 | C15 | C17 | H8 | 173.8° | 178.0° |
| C15 | C18 | C19 | H9 | 176.6° | 178.8° |
| IR07 | C15 | C18 | C21 | 5.9° | 39.6° |
| C15 | IR07 | N14 | C28 | 92.4° | 104.8° |
| C15 | IR07 | N14 | C03 | 40.8° | 150.3° |
| C15 | IR07 | N14 | N10 | 153.1° | 169.1° |
| C15 | IR07 | N14 | N23 | 72.0° | 36.9° |
| C15 | IR07 | C03 | N10 | 154.7° | 158.0° |
| C15 | IR07 | C03 | N23 | 70.5° | 55.8° |
| C15 | IR07 | N10 | N23 | 176.2° | 137.9° |
| C15 | IR07 | C03 | C01 | 21.4° | 36.9° |
| C15 | IR07 | C03 | C06 | 156.5° | 104.7° |
| C15 | IR07 | N23 | C21 | 2.4° | 64.1° |
| C15 | IR07 | N10 | C13 | 111.6° | 144.1° |
| C15 | IR07 | N10 | C08 | 80.4° | 17.3° |
| C15 | IR07 | N23 | C26 | 176.1° | 162.0° |
| IR07 | C15 | C17 | H8 | 3.6° | 40.0° |
| C31 | C28 | N14 | H14 | 180.0° | 177.3° |
| C31 | C28 | N14 | IR07 | 177.7° | 174.8° |
| C28 | C31 | C27 | H13 | 179.5° | 179.7° |
| C18 | C21 | N23 | IR07 | 0.0° | 57.3° |
| C18 | C21 | N23 | C24 | 179.2° | 174.0° |
| C18 | C21 | N23 | C26 | 178.5° | 164.8° |
| C18 | C21 | C24 | C25 | 179.4° | 177.9° |
| C21 | C18 | C19 | H9 | 0.3° | 5.1° |
| C18 | C21 | C24 | H11 | 0.6° | 2.7° |
| C28 | N14 | IR07 | C03 | 133.2° | 45.4° |
| C28 | N14 | IR07 | N10 | 114.5° | 86.1° |
| C28 | N14 | IR07 | N23 | 20.4° | 67.9° |
| N14 | C28 | C31 | H16 | 179.0° | 177.8° |
| N14 | IR07 | C03 | N10 | 115.3° | 43.8° |
| N14 | IR07 | C03 | N23 | 110.0° | 102.4° |
| N14 | IR07 | N10 | N23 | 92.9° | 56.6° |
| N14 | IR07 | C03 | C01 | 60.8° | 121.3° |
| N14 | IR07 | C03 | C06 | 117.0° | 97.1° |
| N14 | IR07 | N23 | C21 | 76.4° | 146.9° |
| N14 | IR07 | N10 | C13 | 20.7° | 21.3° |
| N14 | IR07 | N10 | C08 | 171.3° | 148.2° |
| N14 | IR07 | N23 | C26 | 105.1° | 12.9° |
| IR07 | N14 | C28 | H14 | 2.3° | 7.8° |
| C03 | IR07 | N10 | N23 | 100.4° | 96.4° |
| IR07 | C03 | C01 | C06 | 177.7° | 137.4° |
| IR07 | C03 | C01 | C04 | 179.8° | 127.5° |
| C03 | IR07 | N23 | C21 | 90.1° | 6.7° |
| C03 | IR07 | N10 | C13 | 172.7° | 174.3° |
| C03 | IR07 | N10 | C08 | 4.7° | 58.8° |
| IR07 | C03 | C06 | C08 | 1.1° | 44.2° |
| IR07 | C03 | C06 | C02 | 179.1° | 144.8° |
| C03 | IR07 | N23 | C26 | 88.4° | 127.2° |
| IR07 | C03 | C01 | H1 | 0.2° | 41.4° |
| N10 | IR07 | C03 | C01 | 176.1° | 165.1° |
| N10 | IR07 | C03 | C06 | 1.7° | 53.3° |
| N10 | IR07 | N23 | C21 | 179.4° | 90.3° |
| IR07 | N10 | C13 | C38 | 7.5° | 69.5° |
| IR07 | N10 | C13 | C08 | 167.9° | 116.3° |
| IR07 | N10 | C13 | C09 | 176.8° | 107.5° |
| IR07 | N10 | C08 | C06 | 6.6° | 52.1° |
| IR07 | N10 | C08 | C11 | 178.3° | 129.3° |
| N10 | IR07 | N23 | C26 | 2.1° | 43.6° |
| N23 | IR07 | C03 | C01 | 49.1° | 18.9° |
| N23 | IR07 | C03 | C06 | 133.0° | 160.5° |
| IR07 | N23 | C21 | C26 | 178.5° | 137.8° |
| IR07 | N23 | C21 | C24 | 179.2° | 116.7° |
| N23 | IR07 | N10 | C13 | 72.2° | 77.9° |
| N23 | IR07 | N10 | C08 | 95.8° | 155.2° |
| IR07 | N23 | C26 | C42 | 0.2° | 65.7° |
| IR07 | N23 | C26 | C22 | 179.5° | 107.7° |
| C03 | C01 | C04 | H1 | 180.0° | 169.1° |
| C03 | C01 | C04 | C05 | 2.4° | 8.8° |
| C01 | C03 | C06 | C08 | 179.1° | 166.9° |
| C01 | C03 | C06 | C02 | 1.1° | 4.1° |
| C03 | C01 | C04 | H3 | 177.6° | 172.3° |
| C04 | C01 | C03 | C06 | 2.1° | 9.9° |
| C01 | C04 | C05 | H3 | 180.0° | 178.9° |
| C01 | C04 | C05 | C02 | 1.8° | 1.6° |
| C01 | C04 | C05 | H4 | 178.2° | 178.0° |
| C03 | C06 | C08 | N10 | 5.0° | 13.6° |
| C03 | C06 | C08 | C02 | 179.8° | 170.6° |
| C03 | C06 | C02 | C05 | 0.5° | 2.6° |
| C03 | C06 | C08 | C11 | 179.9° | 167.8° |
| C06 | C03 | C01 | H1 | 178.0° | 178.8° |
| C03 | C06 | C02 | H2 | 179.5° | 178.9° |
| C04 | C05 | C02 | C06 | 0.8° | 3.8° |
| C04 | C05 | C02 | H4 | 180.0° | 179.6° |
| C05 | C04 | C01 | H1 | 177.6° | 177.9° |
| C04 | C05 | C02 | H2 | 179.2° | 179.7° |
| N23 | C21 | C24 | C25 | 1.4° | 10.5° |
| C21 | N23 | C26 | C42 | 178.9° | 167.4° |
| C21 | N23 | C26 | C22 | 1.9° | 19.2° |
| N23 | C21 | C24 | H11 | 178.5° | 168.9° |
| C24 | C21 | N23 | C26 | 2.3° | 21.1° |
| C21 | C24 | C25 | H11 | 180.0° | 179.5° |
| C21 | C24 | C25 | C22 | 0.1° | 2.3° |
| C21 | C24 | C25 | H12 | 179.9° | 176.0° |
| C39 | C38 | C13 | H20 | 180.0° | 178.2° |
| C39 | C38 | C13 | N10 | 176.2° | 177.9° |
| C38 | C39 | C40 | H21 | 180.0° | 179.9° |
| C39 | C38 | C13 | C09 | 0.1° | 0.7° |
| C38 | C39 | C40 | C41 | 0.0° | 1.3° |
| C38 | C39 | C40 | H22 | 180.0° | 180.0° |
| C38 | C13 | N10 | C09 | 175.6° | 177.0° |
| C38 | C13 | N10 | C08 | 175.4° | 174.2° |
| C13 | C38 | C39 | C40 | 0.3° | 0.4° |
| C38 | C13 | C09 | C41 | 0.4° | 0.6° |
| C38 | C13 | C09 | C12 | 179.7° | 179.2° |
| C13 | C38 | C39 | H21 | 179.7° | 179.5° |
| C13 | N10 | C08 | C06 | 175.8° | 171.5° |
| C13 | N10 | C08 | C11 | 9.1° | 7.1° |
| N10 | C13 | C09 | C41 | 175.6° | 176.5° |
| N10 | C13 | C09 | C12 | 4.3° | 3.7° |
| N10 | C13 | C38 | H20 | 3.8° | 3.9° |
| C08 | N10 | C13 | C09 | 8.9° | 8.8° |
| N10 | C08 | C06 | C11 | 175.0° | 178.6° |
| N10 | C08 | C06 | C02 | 175.1° | 157.0° |
| N10 | C08 | C11 | C12 | 5.1° | 0.1° |
| N10 | C08 | C11 | H5 | 174.9° | 174.3° |
| C39 | C40 | C41 | H22 | 180.0° | 178.7° |
| C39 | C40 | C41 | C09 | 0.5° | 2.7° |
| C40 | C39 | C38 | H20 | 179.7° | 178.6° |
| C39 | C40 | C41 | H23 | 179.5° | 178.2° |
| C13 | C09 | C41 | C40 | 0.7° | 2.3° |
| C13 | C09 | C41 | C12 | 179.9° | 179.9° |
| C13 | C09 | C12 | C11 | 0.2° | 3.5° |
| C13 | C09 | C12 | H6 | 179.8° | 177.8° |
| C09 | C13 | C38 | H20 | 179.9° | 178.9° |
| C13 | C09 | C41 | H23 | 179.3° | 177.9° |
| C08 | C06 | C02 | C05 | 179.7° | 172.5° |
| C06 | C08 | C11 | C12 | 179.9° | 178.3° |
| C08 | C06 | C02 | H2 | 0.3° | 11.1° |
| C06 | C08 | C11 | H5 | 0.1° | 7.2° |
| C06 | C02 | C05 | H2 | 180.0° | 176.5° |
| C02 | C06 | C08 | C11 | 0.1° | 21.6° |
| C06 | C02 | C05 | H4 | 179.2° | 176.6° |
| C02 | C05 | C04 | H3 | 178.2° | 179.5° |
| C08 | C11 | C12 | C09 | 0.2° | 5.3° |
| C08 | C11 | C12 | H5 | 180.0° | 174.5° |
| C08 | C11 | C12 | H6 | 179.8° | 179.5° |
| N23 | C26 | C42 | C22 | 179.3° | 173.6° |
| N23 | C26 | C22 | C25 | 0.6° | 7.1° |
| N23 | C26 | C42 | C43 | 178.8° | 176.7° |
| N23 | C26 | C22 | C45 | 178.9° | 173.5° |
| N23 | C26 | C42 | H24 | 1.2° | 4.7° |
| C40 | C41 | C09 | H23 | 180.0° | 175.6° |
| C40 | C41 | C09 | C12 | 179.4° | 177.5° |
| C41 | C40 | C39 | H21 | 180.0° | 178.8° |
| C41 | C09 | C12 | C11 | 179.8° | 176.3° |
| C41 | C09 | C12 | H6 | 0.1° | 2.0° |
| C09 | C41 | C40 | H22 | 179.5° | 178.6° |
| C09 | C12 | C11 | H6 | 180.0° | 174.3° |
| C09 | C12 | C11 | H5 | 179.8° | 179.7° |
| C12 | C09 | C41 | H23 | 0.6° | 2.0° |
| C24 | C25 | C22 | C26 | 0.3° | 3.6° |
| C24 | C25 | C22 | H12 | 180.0° | 173.7° |
| C24 | C25 | C22 | C45 | 179.8° | 175.8° |
| C42 | C26 | C22 | C25 | 179.9° | 179.5° |
| C26 | C42 | C43 | H24 | 180.0° | 178.7° |
| C42 | C26 | C22 | C45 | 0.4° | 0.0° |
| C26 | C42 | C43 | C44 | 0.6° | 2.7° |
| C26 | C42 | C43 | H25 | 179.4° | 179.8° |
| C26 | C22 | C25 | C45 | 179.5° | 179.4° |
| C22 | C26 | C42 | C43 | 0.4° | 3.1° |
| C26 | C22 | C45 | C44 | 0.5° | 3.6° |
| C26 | C22 | C25 | H12 | 179.7° | 177.3° |
| C22 | C26 | C42 | H24 | 179.5° | 178.2° |
| C26 | C22 | C45 | H27 | 179.5° | 175.0° |
| C25 | C22 | C45 | C44 | 180.0° | 175.8° |
| C22 | C25 | C24 | H11 | 179.9° | 178.2° |
| C25 | C22 | C45 | H27 | 0.0° | 4.5° |
| C42 | C43 | C44 | H25 | 180.0° | 177.1° |
| C42 | C43 | C44 | C45 | 0.7° | 1.0° |
| C42 | C43 | C44 | H26 | 179.3° | 179.4° |
| C22 | C45 | C44 | C43 | 0.7° | 4.1° |
| C22 | C45 | C44 | H27 | 180.0° | 171.4° |
| C45 | C22 | C25 | H12 | 0.2° | 2.1° |
| C22 | C45 | C44 | H26 | 179.3° | 177.4° |
| C43 | C44 | C45 | H26 | 180.0° | 178.5° |
| C44 | C43 | C42 | H24 | 179.4° | 178.7° |
| C43 | C44 | C45 | H27 | 179.3° | 175.5° |
| C45 | C44 | C43 | H25 | 179.3° | 176.2° |
| H1 | C01 | C04 | H3 | 2.4° | 3.2° |
| H2 | C02 | C05 | H4 | 0.8° | 0.1° |
| H3 | C04 | C05 | H4 | 1.8° | 0.9° |
| H5 | C11 | C12 | H6 | 0.2° | 6.0° |
| H7 | C16 | C19 | H9 | 0.1° | 0.1° |
| H7 | C16 | C20 | H10 | 0.3° | 1.0° |
| H8 | C17 | C20 | H10 | 3.6° | 1.4° |
| H11 | C24 | C25 | H12 | 0.1° | 4.5° |
| H13 | C27 | C30 | H15 | 0.3° | 1.3° |
| H13 | C27 | C31 | H16 | 0.5° | 0.5° |
| H14 | C28 | C31 | H16 | 1.0° | 0.5° |
| H17 | C35 | C36 | H18 | 0.3° | 1.3° |
| H20 | C38 | C39 | H21 | 0.3° | 1.4° |
| H21 | C39 | C40 | H22 | 0.0° | 0.0° |
| H22 | C40 | C41 | H23 | 0.5° | 3.0° |
| H24 | C42 | C43 | H25 | 0.6° | 1.5° |
| H25 | C43 | C44 | H26 | 0.7° | 2.3° |
| H26 | C44 | C45 | H27 | 0.7° | 6.0° |
| H28 | C46 | N47 | H42 | 60.5° | 152.1° |
| H29 | C46 | N47 | H42 | 179.7° | 91.7° |
| H30 | C49 | C50 | H31 | 174.1° | 92.8° |
| H30 | C49 | C50 | H32 | 55.6° | 156.0° |
| H30 | C49 | N52 | H43 | 175.5° | 168.2° |
| H33 | C57 | C61 | H36 | 1.0° | 0.2° |
| H34 | C59 | C60 | H35 | 1.2° | 0.0° |
| H37 | C62 | C66 | H41 | 0.2° | 0.1° |
| H38 | C63 | C64 | H39 | 0.1° | 1.3° |
| H39 | C64 | C65 | H40 | 0.3° | 0.1° |
| H40 | C65 | C66 | H41 | 0.3° | 0.1° |
