IUN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C13 | sing | 1.53Å | 1.54Å | |
| C10 | C11 | sing | 1.53Å | 1.55Å | |
| C10 | C12 | sing | 1.53Å | 1.52Å | |
| C13 | C15 | sing | 1.53Å | 1.54Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C17 | C20 | sing | 1.54Å | 1.29Å | |
| C17 | C22 | sing | 1.51Å | 1.60Å | |
| C17 | N06 | sing | 1.47Å | 1.56Å | |
| C20 | C21 | sing | 1.55Å | 1.63Å | |
| C21 | C19 | sing | 1.55Å | 1.33Å | |
| C22 | N08 | doub | 1.29Å | 1.40Å | Aromatic |
| C22 | S01 | sing | 1.71Å | 1.58Å | Aromatic |
| C24 | C23 | sing | 1.51Å | 1.52Å | |
| C24 | C27 | sing | 1.53Å | 1.53Å | |
| C24 | N09 | sing | 1.47Å | 1.46Å | |
| C26 | C25 | doub | 1.35Å | 1.44Å | Aromatic |
| C26 | S01 | sing | 1.71Å | 1.52Å | Aromatic |
| C28 | C25 | sing | 1.47Å | 1.50Å | |
| C28 | C30 | sing | 1.48Å | 1.55Å | |
| C28 | O05 | doub | 1.22Å | 1.17Å | |
| C11 | C18 | sing | 1.51Å | 1.51Å | |
| C11 | N07 | sing | 1.47Å | 1.42Å | |
| C12 | C14 | sing | 1.53Å | 1.55Å | |
| C14 | C16 | sing | 1.53Å | 1.54Å | |
| C18 | N06 | sing | 1.35Å | 1.45Å | |
| C18 | O03 | doub | 1.21Å | 1.19Å | |
| C19 | N06 | sing | 1.47Å | 1.50Å | |
| C23 | N07 | sing | 1.35Å | 1.49Å | |
| C23 | O04 | doub | 1.21Å | 1.20Å | |
| C25 | N08 | sing | 1.34Å | 1.57Å | Aromatic |
| C29 | N09 | sing | 1.47Å | 1.43Å | |
| C30 | C31 | doub | 1.40Å | 1.54Å | Aromatic |
| C30 | C32 | sing | 1.40Å | 1.53Å | Aromatic |
| C31 | C33 | sing | 1.38Å | 1.53Å | Aromatic |
| C32 | C34 | doub | 1.38Å | 1.54Å | Aromatic |
| C33 | C35 | doub | 1.39Å | 1.53Å | Aromatic |
| C34 | C35 | sing | 1.39Å | 1.54Å | Aromatic |
| C35 | F02 | sing | 1.35Å | 1.36Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C13 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.09Å | 1.10Å | |
| C15 | H4 | sing | 1.09Å | 1.10Å | |
| C15 | H5 | sing | 1.09Å | 1.10Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C26 | H13 | sing | 1.08Å | 1.08Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| C27 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C29 | H28 | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C31 | H30 | sing | 1.08Å | 1.08Å | |
| C32 | H31 | sing | 1.08Å | 1.08Å | |
| C33 | H32 | sing | 1.08Å | 1.08Å | |
| C34 | H33 | sing | 1.08Å | 1.08Å | |
| N07 | H34 | sing | 0.97Å | 1.00Å | |
| N09 | H37 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C10 | C11 | 108.9° | 109.5° |
| C13 | C10 | C12 | 113.2° | 109.4° |
| C10 | C13 | C15 | 112.3° | 109.5° |
| C13 | C10 | H1 | 108.1° | 109.5° |
| C10 | C13 | H2 | 108.8° | 109.4° |
| C10 | C13 | H3 | 108.7° | 109.5° |
| C11 | C10 | C12 | 110.0° | 109.5° |
| C10 | C11 | C18 | 108.9° | 109.5° |
| C10 | C11 | N07 | 111.0° | 109.5° |
| C11 | C10 | H1 | 108.0° | 109.5° |
| C10 | C11 | H15 | 109.2° | 109.5° |
| C10 | C12 | C14 | 112.2° | 109.5° |
| C12 | C10 | H1 | 108.4° | 109.5° |
| C10 | C12 | H16 | 108.8° | 109.5° |
| C10 | C12 | H17 | 108.8° | 109.5° |
| C13 | C15 | C16 | 111.0° | 109.5° |
| C15 | C13 | H2 | 108.8° | 109.5° |
| C15 | C13 | H3 | 108.8° | 109.5° |
| C13 | C15 | H4 | 109.1° | 109.5° |
| C13 | C15 | H5 | 109.1° | 109.5° |
| C15 | C16 | C14 | 111.7° | 109.5° |
| C16 | C15 | H4 | 109.1° | 109.5° |
| C16 | C15 | H5 | 109.1° | 109.5° |
| C15 | C16 | H20 | 108.9° | 109.5° |
| C15 | C16 | H21 | 108.9° | 109.4° |
| C20 | C17 | C22 | 112.2° | 109.8° |
| C20 | C17 | N06 | 107.6° | 107.3° |
| C17 | C20 | C21 | 107.8° | 103.0° |
| C20 | C17 | H6 | 113.3° | 109.9° |
| C17 | C20 | H7 | 109.9° | 110.8° |
| C17 | C20 | H8 | 109.9° | 110.7° |
| C22 | C17 | N06 | 105.5° | 109.9° |
| C17 | C22 | N08 | 121.5° | 124.7° |
| C17 | C22 | S01 | 129.3° | 124.7° |
| C22 | C17 | H6 | 108.7° | 109.9° |
| C17 | N06 | C18 | 123.9° | 125.7° |
| C17 | N06 | C19 | 107.6° | 108.7° |
| N06 | C17 | H6 | 109.2° | 110.0° |
| C20 | C21 | C19 | 109.1° | 101.6° |
| C21 | C20 | H7 | 109.9° | 110.7° |
| C21 | C20 | H8 | 109.9° | 110.7° |
| C20 | C21 | H9 | 109.6° | 111.1° |
| C20 | C21 | H10 | 109.6° | 111.0° |
| C21 | C19 | N06 | 105.9° | 104.9° |
| C19 | C21 | H9 | 109.6° | 111.0° |
| C19 | C21 | H10 | 109.5° | 111.0° |
| C21 | C19 | H22 | 110.4° | 110.4° |
| C21 | C19 | H23 | 110.4° | 110.4° |
| N08 | C22 | S01 | 109.2° | 110.6° |
| C22 | N08 | C25 | 107.1° | 115.8° |
| C22 | S01 | C26 | 106.3° | 91.2° |
| C23 | C24 | C27 | 107.6° | 109.5° |
| C23 | C24 | N09 | 109.5° | 109.5° |
| C24 | C23 | N07 | 119.2° | 120.0° |
| C24 | C23 | O04 | 122.1° | 120.0° |
| C23 | C24 | H12 | 109.4° | 109.4° |
| C27 | C24 | N09 | 110.9° | 109.5° |
| C27 | C24 | H12 | 109.2° | 109.5° |
| C24 | C27 | H24 | 109.5° | 109.5° |
| C24 | C27 | H25 | 109.5° | 109.5° |
| C24 | C27 | H26 | 109.5° | 109.5° |
| C24 | N09 | C29 | 109.4° | 111.0° |
| N09 | C24 | H12 | 110.2° | 109.5° |
| C24 | N09 | H37 | 109.5° | 111.0° |
| C25 | C26 | S01 | 107.2° | 108.8° |
| C26 | C25 | C28 | 127.5° | 123.1° |
| C26 | C25 | N08 | 110.1° | 113.7° |
| C25 | C26 | H13 | 126.4° | 125.6° |
| S01 | C26 | H13 | 126.4° | 125.6° |
| C25 | C28 | C30 | 117.9° | 120.0° |
| C25 | C28 | O05 | 121.1° | 120.0° |
| C28 | C25 | N08 | 122.4° | 123.2° |
| C30 | C28 | O05 | 121.0° | 120.0° |
| C28 | C30 | C31 | 119.9° | 120.1° |
| C28 | C30 | C32 | 119.0° | 120.1° |
| C18 | C11 | N07 | 107.1° | 109.4° |
| C11 | C18 | N06 | 117.6° | 120.0° |
| C11 | C18 | O03 | 122.7° | 120.0° |
| C18 | C11 | H15 | 109.7° | 109.5° |
| C11 | N07 | C23 | 116.0° | 119.9° |
| N07 | C11 | H15 | 111.0° | 109.5° |
| C11 | N07 | H34 | 122.0° | 120.0° |
| C12 | C14 | C16 | 112.7° | 109.5° |
| C14 | C12 | H16 | 108.8° | 109.5° |
| C14 | C12 | H17 | 108.8° | 109.4° |
| C12 | C14 | H18 | 108.6° | 109.5° |
| C12 | C14 | H19 | 108.7° | 109.5° |
| C16 | C14 | H18 | 108.7° | 109.5° |
| C16 | C14 | H19 | 108.7° | 109.5° |
| C14 | C16 | H20 | 108.9° | 109.5° |
| C14 | C16 | H21 | 108.9° | 109.5° |
| N06 | C18 | O03 | 119.7° | 120.0° |
| C18 | N06 | C19 | 128.5° | 125.7° |
| N06 | C19 | H22 | 110.3° | 110.3° |
| N06 | C19 | H23 | 110.4° | 110.3° |
| N07 | C23 | O04 | 118.7° | 120.0° |
| C23 | N07 | H34 | 122.0° | 120.1° |
| N09 | C29 | H27 | 109.5° | 109.5° |
| N09 | C29 | H28 | 109.5° | 109.5° |
| N09 | C29 | H29 | 109.5° | 109.5° |
| C29 | N09 | H37 | 109.5° | 111.0° |
| C31 | C30 | C32 | 121.1° | 119.8° |
| C30 | C31 | C33 | 118.8° | 119.8° |
| C30 | C31 | H30 | 120.6° | 120.1° |
| C30 | C32 | C34 | 120.1° | 119.9° |
| C30 | C32 | H31 | 119.9° | 120.1° |
| C31 | C33 | C35 | 120.1° | 120.2° |
| C33 | C31 | H30 | 120.6° | 120.1° |
| C31 | C33 | H32 | 120.0° | 119.9° |
| C32 | C34 | C35 | 118.4° | 120.1° |
| C34 | C32 | H31 | 120.0° | 120.0° |
| C32 | C34 | H33 | 120.8° | 120.0° |
| C33 | C35 | C34 | 121.6° | 120.2° |
| C33 | C35 | F02 | 119.1° | 119.9° |
| C35 | C33 | H32 | 120.0° | 119.9° |
| C34 | C35 | F02 | 119.3° | 119.9° |
| C35 | C34 | H33 | 120.8° | 119.9° |
| H2 | C13 | H3 | 109.5° | 109.5° |
| H4 | C15 | H5 | 109.4° | 109.5° |
| H7 | C20 | H8 | 109.5° | 110.8° |
| H9 | C21 | H10 | 109.4° | 110.9° |
| H16 | C12 | H17 | 109.4° | 109.5° |
| H18 | C14 | H19 | 109.5° | 109.4° |
| H20 | C16 | H21 | 109.5° | 109.5° |
| H22 | C19 | H23 | 109.5° | 110.3° |
| H24 | C27 | H25 | 109.5° | 109.5° |
| H24 | C27 | H26 | 109.4° | 109.4° |
| H25 | C27 | H26 | 109.5° | 109.4° |
| H27 | C29 | H28 | 109.5° | 109.5° |
| H27 | C29 | H29 | 109.4° | 109.5° |
| H28 | C29 | H29 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C10 | C11 | C12 | 124.6° | 120.0° |
| C13 | C10 | C11 | H1 | 117.2° | 120.0° |
| C13 | C10 | C12 | H1 | 120.0° | 120.0° |
| C10 | C13 | C15 | H2 | 120.4° | 120.0° |
| C10 | C13 | C15 | H3 | 120.4° | 120.0° |
| C10 | C13 | C15 | C16 | 54.5° | 60.0° |
| C13 | C10 | C11 | C18 | 175.2° | 180.0° |
| C13 | C10 | C11 | N07 | 67.1° | 60.1° |
| C13 | C10 | C12 | C14 | 49.5° | 60.0° |
| C10 | C13 | H2 | H3 | 118.7° | 120.0° |
| C10 | C13 | C15 | H4 | 65.8° | 60.0° |
| C10 | C13 | C15 | H5 | 174.7° | 179.9° |
| C13 | C10 | C11 | H15 | 55.5° | 60.0° |
| C13 | C10 | C12 | H16 | 70.9° | 60.0° |
| C13 | C10 | C12 | H17 | 170.0° | 179.9° |
| C11 | C10 | C12 | H1 | 117.9° | 120.0° |
| C11 | C10 | C13 | C15 | 174.9° | 180.0° |
| C10 | C11 | C18 | N07 | 120.1° | 120.0° |
| C10 | C11 | C18 | H15 | 119.4° | 120.1° |
| C10 | C11 | N07 | H15 | 121.6° | 120.0° |
| C11 | C10 | C12 | C14 | 171.7° | 180.0° |
| C10 | C11 | C18 | N06 | 80.6° | 60.0° |
| C10 | C11 | C18 | O03 | 99.2° | 119.9° |
| C10 | C11 | N07 | C23 | 114.5° | 85.0° |
| C11 | C10 | C13 | H2 | 64.7° | 59.9° |
| C11 | C10 | C13 | H3 | 54.5° | 60.0° |
| C11 | C10 | C12 | H16 | 51.2° | 60.0° |
| C11 | C10 | C12 | H17 | 67.9° | 60.0° |
| C10 | C11 | N07 | H34 | 65.6° | 95.0° |
| C12 | C10 | C13 | C15 | 52.2° | 60.0° |
| C12 | C10 | C11 | C18 | 60.1° | 60.0° |
| C12 | C10 | C11 | N07 | 57.5° | 59.9° |
| C10 | C12 | C14 | H16 | 120.4° | 120.0° |
| C10 | C12 | C14 | H17 | 120.4° | 120.0° |
| C10 | C12 | C14 | C16 | 50.4° | 60.0° |
| C12 | C10 | C13 | H2 | 172.6° | 180.0° |
| C12 | C10 | C13 | H3 | 68.2° | 60.0° |
| C12 | C10 | C11 | H15 | 179.9° | 180.0° |
| C10 | C12 | H16 | H17 | 118.8° | 120.0° |
| C10 | C12 | C14 | H18 | 170.9° | 179.9° |
| C10 | C12 | C14 | H19 | 70.0° | 60.0° |
| C13 | C15 | C16 | H4 | 120.3° | 120.0° |
| C13 | C15 | C16 | H5 | 120.2° | 120.0° |
| C13 | C15 | C16 | C14 | 55.3° | 60.0° |
| C15 | C13 | C10 | H1 | 68.0° | 60.0° |
| C15 | C13 | H2 | H3 | 118.7° | 120.0° |
| C13 | C15 | H4 | H5 | 119.3° | 120.0° |
| C13 | C15 | C16 | H20 | 175.7° | 180.0° |
| C13 | C15 | C16 | H21 | 65.0° | 60.0° |
| C15 | C16 | C14 | C12 | 53.6° | 60.0° |
| C15 | C16 | C14 | H20 | 120.4° | 120.0° |
| C15 | C16 | C14 | H21 | 120.3° | 120.0° |
| C16 | C15 | C13 | H2 | 174.9° | 180.0° |
| C16 | C15 | C13 | H3 | 66.0° | 60.0° |
| C16 | C15 | H4 | H5 | 119.3° | 120.0° |
| C15 | C16 | C14 | H18 | 174.1° | 180.0° |
| C15 | C16 | C14 | H19 | 66.8° | 60.0° |
| C15 | C16 | H20 | H21 | 119.0° | 120.0° |
| C20 | C17 | C22 | N06 | 116.9° | 117.8° |
| C20 | C17 | C22 | H6 | 126.1° | 121.0° |
| C20 | C17 | N06 | H6 | 123.4° | 119.5° |
| C17 | C20 | C21 | H7 | 119.7° | 118.4° |
| C17 | C20 | C21 | H8 | 119.7° | 118.4° |
| C17 | C20 | C21 | C19 | 12.2° | 35.5° |
| C20 | C17 | C22 | N08 | 94.3° | 106.5° |
| C20 | C17 | C22 | S01 | 86.0° | 73.2° |
| C20 | C17 | N06 | C18 | 176.6° | 178.9° |
| C20 | C17 | N06 | C19 | 4.0° | 1.1° |
| C17 | C20 | H7 | H8 | 120.8° | 123.2° |
| C17 | C20 | C21 | H9 | 132.2° | 153.6° |
| C17 | C20 | C21 | H10 | 107.7° | 82.5° |
| C22 | C17 | N06 | H6 | 116.7° | 121.1° |
| C22 | C17 | C20 | C21 | 119.6° | 141.6° |
| C17 | C22 | N08 | S01 | 179.7° | 179.8° |
| C17 | C22 | S01 | C26 | 180.0° | 180.0° |
| C22 | C17 | N06 | C18 | 63.5° | 61.7° |
| C22 | C17 | N06 | C19 | 115.9° | 118.3° |
| C17 | C22 | N08 | C25 | 179.8° | 180.0° |
| C22 | C17 | C20 | H7 | 0.1° | 23.2° |
| C22 | C17 | C20 | H8 | 120.6° | 100.1° |
| N06 | C17 | C20 | C21 | 4.1° | 22.2° |
| C17 | N06 | C19 | C21 | 11.7° | 24.1° |
| N06 | C17 | C22 | N08 | 148.8° | 135.8° |
| N06 | C17 | C22 | S01 | 30.9° | 44.5° |
| C17 | N06 | C18 | C11 | 178.9° | 180.0° |
| C17 | N06 | C18 | C19 | 179.3° | 180.0° |
| C17 | N06 | C18 | O03 | 0.9° | 0.1° |
| N06 | C17 | C20 | H7 | 115.7° | 96.2° |
| N06 | C17 | C20 | H8 | 123.8° | 140.5° |
| C17 | N06 | C19 | H22 | 107.7° | 94.8° |
| C17 | N06 | C19 | H23 | 131.2° | 143.0° |
| C20 | C21 | C19 | H9 | 120.0° | 118.1° |
| C20 | C21 | C19 | H10 | 120.0° | 118.0° |
| C20 | C21 | C19 | N06 | 13.9° | 37.0° |
| C21 | C20 | C17 | H6 | 116.8° | 97.4° |
| C21 | C20 | H7 | H8 | 120.8° | 123.2° |
| C20 | C21 | H9 | H10 | 120.2° | 124.0° |
| C20 | C21 | C19 | H22 | 105.5° | 81.9° |
| C20 | C21 | C19 | H23 | 133.4° | 155.8° |
| C21 | C19 | N06 | C18 | 168.9° | 155.9° |
| C21 | C19 | N06 | H22 | 119.4° | 118.9° |
| C21 | C19 | N06 | H23 | 119.5° | 118.9° |
| C19 | C21 | C20 | H7 | 107.5° | 82.9° |
| C19 | C21 | C20 | H8 | 131.9° | 153.9° |
| C19 | C21 | H9 | H10 | 120.1° | 123.9° |
| C21 | C19 | H22 | H23 | 121.7° | 122.3° |
| C22 | N08 | C25 | C26 | 0.5° | 0.1° |
| N08 | C22 | S01 | C26 | 0.3° | 0.3° |
| C22 | N08 | C25 | C28 | 179.8° | 179.8° |
| N08 | C22 | C17 | H6 | 31.8° | 14.5° |
| C22 | S01 | C26 | C25 | 0.0° | 0.2° |
| S01 | C22 | N08 | C25 | 0.5° | 0.3° |
| S01 | C22 | C17 | H6 | 147.8° | 165.8° |
| C22 | S01 | C26 | H13 | 180.0° | 179.9° |
| C23 | C24 | C27 | N09 | 119.8° | 120.0° |
| C23 | C24 | C27 | H12 | 118.6° | 120.0° |
| C23 | C24 | N09 | H12 | 120.4° | 120.0° |
| C24 | C23 | N07 | C11 | 179.8° | 180.0° |
| C24 | C23 | N07 | O04 | 179.6° | 179.9° |
| C23 | C24 | N09 | C29 | 76.9° | 155.0° |
| C23 | C24 | C27 | H24 | 180.0° | 60.0° |
| C23 | C24 | C27 | H25 | 60.0° | 60.0° |
| C23 | C24 | C27 | H26 | 60.0° | 180.0° |
| C24 | C23 | N07 | H34 | 0.2° | 0.0° |
| C23 | C24 | N09 | H37 | 43.0° | 31.0° |
| C27 | C24 | N09 | H12 | 121.0° | 120.0° |
| C27 | C24 | C23 | N07 | 87.4° | 60.0° |
| C27 | C24 | C23 | O04 | 92.2° | 120.0° |
| C27 | C24 | N09 | C29 | 164.5° | 85.0° |
| C24 | C27 | H24 | H25 | 120.0° | 120.1° |
| C24 | C27 | H24 | H26 | 120.0° | 120.0° |
| C24 | C27 | H25 | H26 | 120.0° | 120.0° |
| C27 | C24 | N09 | H37 | 75.6° | 151.0° |
| N09 | C24 | C23 | N07 | 151.9° | 180.0° |
| N09 | C24 | C23 | O04 | 28.4° | 0.1° |
| C24 | N09 | C29 | H37 | 120.0° | 123.9° |
| N09 | C24 | C27 | H24 | 60.2° | 60.0° |
| N09 | C24 | C27 | H25 | 59.8° | 179.9° |
| N09 | C24 | C27 | H26 | 179.8° | 60.0° |
| C24 | N09 | C29 | H27 | 180.0° | 180.0° |
| C24 | N09 | C29 | H28 | 60.0° | 60.0° |
| C24 | N09 | C29 | H29 | 60.0° | 60.0° |
| C25 | C26 | S01 | H13 | 180.0° | 179.9° |
| C26 | C25 | C28 | N08 | 179.1° | 179.9° |
| C26 | C25 | C28 | C30 | 144.6° | 174.7° |
| C26 | C25 | C28 | O05 | 33.5° | 5.3° |
| S01 | C26 | C25 | C28 | 179.6° | 180.0° |
| S01 | C26 | C25 | N08 | 0.3° | 0.1° |
| C25 | C28 | C30 | O05 | 178.1° | 180.0° |
| C25 | C28 | C30 | C31 | 149.6° | 173.8° |
| C25 | C28 | C30 | C32 | 31.5° | 5.9° |
| C28 | C25 | C26 | H13 | 0.4° | 0.1° |
| C30 | C28 | C25 | N08 | 34.6° | 5.2° |
| C28 | C30 | C31 | C32 | 178.9° | 179.7° |
| C28 | C30 | C31 | C33 | 179.1° | 180.0° |
| C28 | C30 | C32 | C34 | 178.9° | 180.0° |
| C28 | C30 | C31 | H30 | 0.9° | 0.0° |
| C28 | C30 | C32 | H31 | 1.1° | 0.1° |
| O05 | C28 | C25 | N08 | 147.4° | 174.8° |
| O05 | C28 | C30 | C31 | 32.3° | 6.2° |
| O05 | C28 | C30 | C32 | 146.6° | 174.1° |
| C18 | C11 | N07 | H15 | 119.7° | 120.0° |
| C11 | C18 | N06 | O03 | 179.8° | 179.9° |
| C11 | C18 | N06 | C19 | 0.4° | 0.0° |
| C18 | C11 | N07 | C23 | 126.8° | 155.0° |
| C18 | C11 | C10 | H1 | 58.0° | 60.0° |
| C18 | C11 | N07 | H34 | 53.2° | 25.0° |
| N07 | C11 | C18 | N06 | 159.3° | 180.0° |
| N07 | C11 | C18 | O03 | 20.9° | 0.0° |
| C11 | N07 | C23 | H34 | 180.0° | 180.0° |
| C11 | N07 | C23 | O04 | 0.1° | 0.0° |
| N07 | C11 | C10 | H1 | 175.7° | 180.0° |
| C12 | C14 | C16 | H18 | 120.5° | 120.0° |
| C12 | C14 | C16 | H19 | 120.5° | 120.0° |
| C14 | C12 | C10 | H1 | 70.4° | 60.0° |
| C14 | C12 | H16 | H17 | 118.8° | 120.0° |
| C12 | C14 | H18 | H19 | 118.5° | 120.0° |
| C12 | C14 | C16 | H20 | 174.0° | 180.0° |
| C12 | C14 | C16 | H21 | 66.7° | 60.0° |
| C14 | C16 | C15 | H4 | 64.9° | 60.0° |
| C14 | C16 | C15 | H5 | 175.5° | 179.9° |
| C16 | C14 | C12 | H16 | 70.0° | 60.0° |
| C16 | C14 | C12 | H17 | 170.9° | 180.0° |
| C16 | C14 | H18 | H19 | 118.6° | 120.0° |
| C14 | C16 | H20 | H21 | 119.0° | 120.0° |
| C18 | N06 | C17 | H6 | 53.2° | 59.5° |
| N06 | C18 | C11 | H15 | 38.7° | 60.1° |
| C18 | N06 | C19 | H22 | 71.7° | 85.2° |
| C18 | N06 | C19 | H23 | 49.4° | 37.0° |
| O03 | C18 | N06 | C19 | 179.8° | 179.9° |
| O03 | C18 | C11 | H15 | 141.5° | 120.0° |
| C19 | N06 | C17 | H6 | 127.4° | 120.5° |
| N06 | C19 | C21 | H9 | 133.9° | 155.1° |
| N06 | C19 | C21 | H10 | 106.0° | 81.0° |
| N06 | C19 | H22 | H23 | 121.6° | 122.2° |
| N07 | C23 | C24 | H12 | 31.1° | 60.0° |
| C23 | N07 | C11 | H15 | 7.1° | 35.0° |
| O04 | C23 | C24 | H12 | 149.3° | 120.0° |
| O04 | C23 | N07 | H34 | 179.9° | 180.0° |
| N08 | C25 | C26 | H13 | 179.7° | 180.0° |
| C29 | N09 | C24 | H12 | 43.4° | 35.0° |
| N09 | C29 | H27 | H28 | 120.0° | 120.0° |
| N09 | C29 | H27 | H29 | 120.0° | 120.0° |
| N09 | C29 | H28 | H29 | 120.0° | 120.0° |
| C30 | C31 | C33 | H30 | 180.0° | 180.0° |
| C31 | C30 | C32 | C34 | 0.0° | 0.3° |
| C30 | C31 | C33 | C35 | 0.3° | 0.0° |
| C31 | C30 | C32 | H31 | 180.0° | 179.7° |
| C30 | C31 | C33 | H32 | 179.7° | 180.0° |
| C32 | C30 | C31 | C33 | 0.2° | 0.3° |
| C30 | C32 | C34 | H31 | 180.0° | 180.0° |
| C30 | C32 | C34 | C35 | 0.2° | 0.0° |
| C32 | C30 | C31 | H30 | 179.8° | 179.7° |
| C30 | C32 | C34 | H33 | 179.8° | 180.0° |
| C31 | C33 | C35 | H32 | 180.0° | 180.0° |
| C31 | C33 | C35 | C34 | 0.1° | 0.3° |
| C31 | C33 | C35 | F02 | 179.8° | 179.9° |
| C32 | C34 | C35 | C33 | 0.1° | 0.3° |
| C32 | C34 | C35 | H33 | 180.0° | 180.0° |
| C32 | C34 | C35 | F02 | 179.6° | 180.0° |
| C33 | C35 | C34 | F02 | 179.8° | 179.6° |
| C35 | C33 | C31 | H30 | 179.8° | 180.0° |
| C33 | C35 | C34 | H33 | 179.9° | 179.7° |
| C35 | C34 | C32 | H31 | 179.8° | 180.0° |
| C34 | C35 | C33 | H32 | 179.9° | 179.7° |
| F02 | C35 | C33 | H32 | 0.2° | 0.1° |
| F02 | C35 | C34 | H33 | 0.4° | 0.1° |
| H1 | C10 | C13 | H2 | 52.5° | 60.1° |
| H1 | C10 | C13 | H3 | 171.6° | 180.0° |
| H1 | C10 | C11 | H15 | 61.7° | 60.0° |
| H1 | C10 | C12 | H16 | 169.1° | 180.0° |
| H1 | C10 | C12 | H17 | 50.0° | 60.0° |
| H2 | C13 | C15 | H4 | 54.7° | 60.0° |
| H2 | C13 | C15 | H5 | 64.9° | 60.1° |
| H3 | C13 | C15 | H4 | 173.8° | 180.0° |
| H3 | C13 | C15 | H5 | 54.3° | 59.9° |
| H4 | C15 | C16 | H20 | 55.4° | 60.1° |
| H4 | C15 | C16 | H21 | 174.7° | 180.0° |
| H5 | C15 | C16 | H20 | 64.1° | 60.0° |
| H5 | C15 | C16 | H21 | 55.2° | 60.0° |
| H6 | C17 | C20 | H7 | 123.5° | 144.2° |
| H6 | C17 | C20 | H8 | 3.0° | 21.0° |
| H7 | C20 | C21 | H9 | 12.4° | 35.1° |
| H7 | C20 | C21 | H10 | 132.5° | 159.1° |
| H8 | C20 | C21 | H9 | 108.1° | 88.1° |
| H8 | C20 | C21 | H10 | 12.0° | 35.9° |
| H9 | C21 | C19 | H22 | 14.5° | 36.3° |
| H9 | C21 | C19 | H23 | 106.7° | 86.0° |
| H10 | C21 | C19 | H22 | 134.5° | 160.1° |
| H10 | C21 | C19 | H23 | 13.4° | 37.8° |
| H12 | C24 | C27 | H24 | 61.4° | 180.0° |
| H12 | C24 | C27 | H25 | 178.6° | 59.9° |
| H12 | C24 | C27 | H26 | 58.6° | 60.0° |
| H12 | C24 | N09 | H37 | 163.4° | 88.9° |
| H15 | C11 | N07 | H34 | 172.9° | 145.0° |
| H16 | C12 | C14 | H18 | 50.5° | 60.1° |
| H16 | C12 | C14 | H19 | 169.6° | 180.0° |
| H17 | C12 | C14 | H18 | 68.6° | 60.0° |
| H17 | C12 | C14 | H19 | 50.4° | 60.0° |
| H18 | C14 | C16 | H20 | 65.5° | 60.0° |
| H18 | C14 | C16 | H21 | 53.8° | 60.1° |
| H19 | C14 | C16 | H20 | 53.5° | 60.0° |
| H19 | C14 | C16 | H21 | 172.8° | 180.0° |
| H24 | C27 | H25 | H26 | 120.0° | 120.0° |
| H27 | C29 | H28 | H29 | 120.0° | 120.0° |
| H27 | C29 | N09 | H37 | 60.0° | 56.0° |
| H28 | C29 | N09 | H37 | 180.0° | 176.1° |
| H29 | C29 | N09 | H37 | 60.0° | 63.9° |
| H30 | C31 | C33 | H32 | 0.2° | 0.0° |
| H31 | C32 | C34 | H33 | 0.2° | 0.0° |
