YEH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | sing | 1.47Å | 1.52Å | |
| N1 | C5 | sing | 1.47Å | 1.50Å | |
| N1 | C15 | sing | 1.35Å | 1.42Å | |
| C2 | C3 | sing | 1.54Å | 1.52Å | |
| C3 | C4 | sing | 1.55Å | 1.58Å | |
| C3 | C6 | sing | 1.53Å | 1.55Å | |
| C4 | C5 | sing | 1.54Å | 1.56Å | |
| C4 | C7 | sing | 1.54Å | 1.55Å | |
| C6 | C7 | sing | 1.55Å | 1.58Å | |
| C6 | C8 | sing | 1.54Å | 1.54Å | |
| C7 | C10 | sing | 1.54Å | 1.55Å | |
| C8 | N9 | sing | 1.47Å | 1.51Å | |
| N9 | C10 | sing | 1.47Å | 1.50Å | |
| C15 | O16 | doub | 1.22Å | 1.23Å | |
| C15 | C28 | sing | 1.48Å | 1.52Å | |
| C28 | C29 | doub | 1.40Å | 1.41Å | Aromatic |
| C28 | C31 | sing | 1.39Å | 1.42Å | Aromatic |
| C29 | C30 | sing | 1.36Å | 1.40Å | Aromatic |
| C30 | C33 | doub | 1.39Å | 1.41Å | Aromatic |
| C31 | C32 | doub | 1.39Å | 1.39Å | Aromatic |
| C32 | C33 | sing | 1.41Å | 1.42Å | Aromatic |
| C32 | N34 | sing | 1.38Å | 1.39Å | Aromatic |
| C33 | C36 | sing | 1.47Å | 1.42Å | Aromatic |
| N34 | C35 | sing | 1.38Å | 1.38Å | Aromatic |
| C35 | C36 | doub | 1.40Å | 1.43Å | Aromatic |
| C35 | C40 | sing | 1.39Å | 1.39Å | Aromatic |
| C36 | C37 | sing | 1.39Å | 1.39Å | Aromatic |
| C37 | C38 | doub | 1.38Å | 1.36Å | Aromatic |
| C38 | C39 | sing | 1.39Å | 1.42Å | Aromatic |
| C38 | CL41 | sing | 1.74Å | 1.69Å | |
| C39 | C40 | doub | 1.38Å | 1.40Å | Aromatic |
| C10 | H48 | sing | 1.09Å | 1.10Å | |
| C10 | H49 | sing | 1.09Å | 1.10Å | |
| C2 | H43 | sing | 1.09Å | 1.10Å | |
| C2 | H42 | sing | 1.09Å | 1.10Å | |
| C3 | H12 | sing | 1.09Å | 1.10Å | |
| C4 | H11 | sing | 1.09Å | 1.10Å | |
| C5 | H44 | sing | 1.09Å | 1.10Å | |
| C5 | H45 | sing | 1.09Å | 1.10Å | |
| C6 | H14 | sing | 1.09Å | 1.10Å | |
| C7 | H13 | sing | 1.09Å | 1.10Å | |
| C8 | H47 | sing | 1.09Å | 1.10Å | |
| C8 | H46 | sing | 1.09Å | 1.10Å | |
| C29 | H54 | sing | 1.08Å | 1.08Å | |
| C30 | H55 | sing | 1.08Å | 1.08Å | |
| C31 | H56 | sing | 1.08Å | 1.08Å | |
| N34 | H57 | sing | 0.97Å | 1.00Å | |
| C37 | H58 | sing | 1.08Å | 1.08Å | |
| C39 | H59 | sing | 1.08Å | 1.08Å | |
| C40 | H60 | sing | 1.08Å | 1.08Å | |
| N9 | C1 | sing | 1.35Å | 42.49Å | |
| C1 | O1 | doub | 1.22Å | 0.00Å | |
| C1 | C11 | sing | 1.48Å | 0.00Å | |
| C11 | C12 | doub | 1.40Å | 0.00Å | Aromatic |
| C12 | C13 | sing | 1.36Å | 0.00Å | Aromatic |
| C13 | C9 | doub | 1.39Å | 0.00Å | Aromatic |
| C9 | C14 | sing | 1.41Å | 0.00Å | Aromatic |
| C14 | C17 | doub | 1.40Å | 0.00Å | Aromatic |
| C17 | C11 | sing | 1.39Å | 0.00Å | Aromatic |
| C14 | N3 | sing | 1.35Å | 0.00Å | Aromatic |
| N3 | N4 | doub | 1.29Å | 0.00Å | Aromatic |
| N4 | N5 | sing | 1.40Å | 0.00Å | Aromatic |
| N5 | C9 | sing | 1.37Å | 0.00Å | Aromatic |
| C12 | H1 | sing | 1.08Å | 0.00Å | |
| C13 | H2 | sing | 1.08Å | 0.00Å | |
| C17 | H3 | sing | 1.08Å | 0.00Å | |
| N5 | H4 | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | N1 | C5 | 111.7° | 109.3° |
| C2 | N1 | C15 | 121.7° | 125.3° |
| N1 | C2 | C3 | 103.7° | 106.7° |
| N1 | C2 | H43 | 110.9° | 110.1° |
| N1 | C2 | H42 | 110.9° | 110.1° |
| C5 | N1 | C15 | 124.3° | 125.4° |
| N1 | C5 | C4 | 104.4° | 108.0° |
| N1 | C5 | H44 | 110.7° | 109.8° |
| N1 | C5 | H45 | 110.8° | 109.7° |
| N1 | C15 | O16 | 117.6° | 120.1° |
| N1 | C15 | C28 | 121.8° | 120.0° |
| C2 | C3 | C4 | 108.8° | 103.7° |
| C2 | C3 | C6 | 113.6° | 113.9° |
| C3 | C2 | H43 | 110.9° | 109.9° |
| C3 | C2 | H42 | 110.9° | 110.0° |
| C2 | C3 | H12 | 114.5° | 115.0° |
| C4 | C3 | C6 | 90.2° | 87.2° |
| C3 | C4 | C5 | 105.9° | 104.5° |
| C3 | C4 | C7 | 89.8° | 87.1° |
| C4 | C3 | H12 | 113.5° | 116.6° |
| C3 | C4 | H11 | 114.0° | 116.6° |
| C3 | C6 | C7 | 89.8° | 87.2° |
| C3 | C6 | C8 | 117.1° | 113.9° |
| C6 | C3 | H12 | 113.9° | 116.7° |
| C3 | C6 | H14 | 113.1° | 115.7° |
| C5 | C4 | C7 | 115.5° | 113.3° |
| C5 | C4 | H11 | 114.4° | 115.0° |
| C4 | C5 | H44 | 110.7° | 109.8° |
| C4 | C5 | H45 | 110.7° | 109.8° |
| C4 | C7 | C6 | 90.2° | 87.1° |
| C4 | C7 | C10 | 116.7° | 113.2° |
| C7 | C4 | H11 | 114.4° | 116.8° |
| C4 | C7 | H13 | 113.7° | 116.3° |
| C7 | C6 | C8 | 108.6° | 104.5° |
| C6 | C7 | C10 | 106.6° | 103.6° |
| C7 | C6 | H14 | 112.6° | 116.4° |
| C6 | C7 | H13 | 113.3° | 117.6° |
| C6 | C8 | N9 | 103.1° | 107.9° |
| C8 | C6 | H14 | 113.3° | 115.4° |
| C6 | C8 | H47 | 111.0° | 109.7° |
| C6 | C8 | H46 | 111.0° | 109.8° |
| C7 | C10 | N9 | 104.0° | 106.7° |
| C7 | C10 | H48 | 110.8° | 110.0° |
| C7 | C10 | H49 | 110.8° | 110.0° |
| C10 | C7 | H13 | 113.8° | 115.3° |
| C8 | N9 | C10 | 113.1° | 109.4° |
| N9 | C8 | H47 | 111.0° | 109.8° |
| N9 | C8 | H46 | 111.0° | 109.8° |
| C8 | N9 | C1 | 66.2° | 125.3° |
| N9 | C10 | H48 | 110.8° | 110.0° |
| N9 | C10 | H49 | 110.8° | 110.0° |
| C10 | N9 | C1 | 177.4° | 125.3° |
| O16 | C15 | C28 | 120.6° | 119.9° |
| C15 | C28 | C29 | 123.2° | 119.9° |
| C15 | C28 | C31 | 114.5° | 119.8° |
| C29 | C28 | C31 | 122.1° | 120.3° |
| C28 | C29 | C30 | 120.2° | 120.3° |
| C28 | C29 | H54 | 119.9° | 119.8° |
| C28 | C31 | C32 | 117.1° | 119.7° |
| C28 | C31 | H56 | 121.4° | 120.2° |
| C29 | C30 | C33 | 117.8° | 120.1° |
| C30 | C29 | H54 | 119.9° | 119.9° |
| C29 | C30 | H55 | 121.1° | 119.9° |
| C30 | C33 | C32 | 121.3° | 120.3° |
| C30 | C33 | C36 | 132.7° | 133.3° |
| C33 | C30 | H55 | 121.1° | 120.0° |
| C31 | C32 | C33 | 121.5° | 119.4° |
| C31 | C32 | N34 | 128.8° | 132.3° |
| C32 | C31 | H56 | 121.5° | 120.1° |
| C33 | C32 | N34 | 109.7° | 108.3° |
| C32 | C33 | C36 | 106.0° | 106.4° |
| C32 | N34 | C35 | 108.0° | 110.3° |
| C32 | N34 | H57 | 126.0° | 124.8° |
| C33 | C36 | C35 | 107.6° | 106.6° |
| C33 | C36 | C37 | 131.1° | 133.4° |
| N34 | C35 | C36 | 108.7° | 108.4° |
| N34 | C35 | C40 | 128.7° | 132.3° |
| C35 | N34 | H57 | 126.0° | 124.9° |
| C36 | C35 | C40 | 122.6° | 119.3° |
| C35 | C36 | C37 | 121.4° | 120.1° |
| C35 | C40 | C39 | 116.0° | 120.1° |
| C35 | C40 | H60 | 122.0° | 119.9° |
| C36 | C37 | C38 | 115.2° | 119.8° |
| C36 | C37 | H58 | 122.4° | 120.1° |
| C37 | C38 | C39 | 125.1° | 120.2° |
| C37 | C38 | CL41 | 115.4° | 119.9° |
| C38 | C37 | H58 | 122.4° | 120.1° |
| C39 | C38 | CL41 | 119.4° | 119.9° |
| C38 | C39 | C40 | 119.7° | 120.5° |
| C38 | C39 | H59 | 120.1° | 119.7° |
| C40 | C39 | H59 | 120.2° | 119.8° |
| C39 | C40 | H60 | 122.0° | 119.9° |
| H48 | C10 | H49 | 109.5° | 110.0° |
| H43 | C2 | H42 | 109.5° | 110.0° |
| H44 | C5 | H45 | 109.5° | 109.8° |
| H47 | C8 | H46 | 109.4° | 109.8° |
| N9 | C1 | O1 | 90.0° | 120.0° |
| N9 | C1 | C11 | 90.0° | 120.0° |
| O1 | C1 | C11 | 90.0° | 120.0° |
| C1 | C11 | C12 | 90.0° | 119.9° |
| C1 | C11 | C17 | 90.0° | 119.9° |
| C11 | C12 | C13 | 90.0° | 120.4° |
| C12 | C11 | C17 | 90.0° | 120.3° |
| C11 | C12 | H1 | 90.0° | 119.8° |
| C12 | C13 | C9 | 90.0° | 120.1° |
| C13 | C12 | H1 | 90.0° | 119.8° |
| C12 | C13 | H2 | 90.0° | 119.9° |
| C13 | C9 | C14 | 90.0° | 120.2° |
| C13 | C9 | N5 | 90.0° | 133.7° |
| C9 | C13 | H2 | 90.0° | 119.9° |
| C9 | C14 | C17 | 90.0° | 119.4° |
| C9 | C14 | N3 | 90.0° | 107.6° |
| C14 | C9 | N5 | 90.0° | 106.1° |
| C14 | C17 | C11 | 90.0° | 119.5° |
| C17 | C14 | N3 | 90.0° | 133.0° |
| C14 | C17 | H3 | 90.0° | 120.2° |
| C11 | C17 | H3 | 90.0° | 120.2° |
| C14 | N3 | N4 | 90.0° | 110.1° |
| N3 | N4 | N5 | 90.0° | 109.5° |
| N4 | N5 | C9 | 90.0° | 106.7° |
| N4 | N5 | H4 | 90.0° | 126.6° |
| C9 | N5 | H4 | 90.0° | 126.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | N1 | C5 | C15 | 162.6° | 180.0° |
| N1 | C2 | C3 | H43 | 119.1° | 119.4° |
| N1 | C2 | C3 | H42 | 119.1° | 119.4° |
| N1 | C2 | C3 | C4 | 13.1° | 27.3° |
| N1 | C2 | C3 | C6 | 111.9° | 65.7° |
| C2 | N1 | C5 | C4 | 23.8° | 1.3° |
| C2 | N1 | C15 | O16 | 179.5° | 5.6° |
| C2 | N1 | C15 | C28 | 1.1° | 174.4° |
| N1 | C2 | H43 | H42 | 122.7° | 121.4° |
| N1 | C2 | C3 | H12 | 115.0° | 155.8° |
| C2 | N1 | C5 | H44 | 143.0° | 118.4° |
| C2 | N1 | C5 | H45 | 95.3° | 120.9° |
| C5 | N1 | C2 | C3 | 23.4° | 18.2° |
| N1 | C5 | C4 | C3 | 14.1° | 15.8° |
| N1 | C5 | C4 | H44 | 119.2° | 119.7° |
| N1 | C5 | C4 | H45 | 119.2° | 119.5° |
| N1 | C5 | C4 | C7 | 111.7° | 108.9° |
| C5 | N1 | C15 | O16 | 19.5° | 174.5° |
| C5 | N1 | C15 | C28 | 159.9° | 5.5° |
| C5 | N1 | C2 | H43 | 95.6° | 137.4° |
| C5 | N1 | C2 | H42 | 142.5° | 101.2° |
| N1 | C5 | C4 | H11 | 112.3° | 113.3° |
| N1 | C5 | H44 | H45 | 122.4° | 120.7° |
| C15 | N1 | C2 | C3 | 139.7° | 161.9° |
| C15 | N1 | C5 | C4 | 138.8° | 178.7° |
| N1 | C15 | O16 | C28 | 179.5° | 180.0° |
| N1 | C15 | C28 | C29 | 39.0° | 138.2° |
| N1 | C15 | C28 | C31 | 136.2° | 41.5° |
| C15 | N1 | C2 | H43 | 101.2° | 42.6° |
| C15 | N1 | C2 | H42 | 20.7° | 78.8° |
| C15 | N1 | C5 | H44 | 19.6° | 61.5° |
| C15 | N1 | C5 | H45 | 102.0° | 59.2° |
| C2 | C3 | C4 | C6 | 115.0° | 113.9° |
| C2 | C3 | C4 | H12 | 128.7° | 127.5° |
| C2 | C3 | C6 | H12 | 133.4° | 137.7° |
| C2 | C3 | C4 | C5 | 0.5° | 25.9° |
| C2 | C3 | C4 | C7 | 117.0° | 139.2° |
| C2 | C3 | C6 | C7 | 112.6° | 128.8° |
| C2 | C3 | C6 | C8 | 136.5° | 126.5° |
| C3 | C2 | H43 | H42 | 122.6° | 121.3° |
| C2 | C3 | C4 | H11 | 126.1° | 102.2° |
| C2 | C3 | C6 | H14 | 2.1° | 10.8° |
| C4 | C3 | C6 | H12 | 115.9° | 118.5° |
| C3 | C4 | C5 | C7 | 97.5° | 93.1° |
| C3 | C4 | C5 | H11 | 126.4° | 129.1° |
| C3 | C4 | C7 | H11 | 116.5° | 118.5° |
| C4 | C3 | C6 | C7 | 2.0° | 25.1° |
| C4 | C3 | C6 | C8 | 112.8° | 129.7° |
| C3 | C4 | C7 | C10 | 106.7° | 78.6° |
| C4 | C3 | C2 | H43 | 106.0° | 146.7° |
| C4 | C3 | C2 | H42 | 132.2° | 92.1° |
| C3 | C4 | C5 | H44 | 133.3° | 135.5° |
| C3 | C4 | C5 | H45 | 105.1° | 103.7° |
| C4 | C3 | C6 | H14 | 112.7° | 93.0° |
| C3 | C4 | C7 | H13 | 117.7° | 144.5° |
| C6 | C3 | C4 | C5 | 114.6° | 88.0° |
| C3 | C6 | C7 | C8 | 118.7° | 114.0° |
| C3 | C6 | C7 | H14 | 115.0° | 117.4° |
| C3 | C6 | C8 | H14 | 134.4° | 137.4° |
| C3 | C6 | C7 | C10 | 116.0° | 87.9° |
| C3 | C6 | C8 | N9 | 109.9° | 77.3° |
| C6 | C3 | C2 | H43 | 7.2° | 53.6° |
| C6 | C3 | C2 | H42 | 129.1° | 174.8° |
| C6 | C3 | C4 | H11 | 118.8° | 143.9° |
| C3 | C6 | C7 | H13 | 118.0° | 143.6° |
| C3 | C6 | C8 | H47 | 131.1° | 163.1° |
| C3 | C6 | C8 | H46 | 9.1° | 42.3° |
| C5 | C4 | C7 | H11 | 136.0° | 137.0° |
| C5 | C4 | C7 | C6 | 105.6° | 79.5° |
| C5 | C4 | C7 | C10 | 145.7° | 176.9° |
| C5 | C4 | C3 | H12 | 129.2° | 153.3° |
| C4 | C5 | H44 | H45 | 122.3° | 120.8° |
| C5 | C4 | C7 | H13 | 10.2° | 39.9° |
| C4 | C7 | C6 | C10 | 118.0° | 113.1° |
| C4 | C7 | C6 | H13 | 116.0° | 118.3° |
| C4 | C7 | C6 | C8 | 120.7° | 139.2° |
| C4 | C7 | C10 | H13 | 135.5° | 137.4° |
| C4 | C7 | C10 | N9 | 113.4° | 120.2° |
| C4 | C7 | C10 | H48 | 5.7° | 0.9° |
| C4 | C7 | C10 | H49 | 127.5° | 120.5° |
| C7 | C4 | C3 | H12 | 114.3° | 93.4° |
| C7 | C4 | C5 | H44 | 129.1° | 131.4° |
| C7 | C4 | C5 | H45 | 7.5° | 10.6° |
| C4 | C7 | C6 | H14 | 113.0° | 92.2° |
| C7 | C6 | C8 | H14 | 125.9° | 129.2° |
| C6 | C7 | C10 | H13 | 125.7° | 129.9° |
| C7 | C6 | C8 | N9 | 10.2° | 16.1° |
| C6 | C7 | C10 | N9 | 14.6° | 27.5° |
| C6 | C7 | C10 | H48 | 104.5° | 91.9° |
| C6 | C7 | C10 | H49 | 133.7° | 146.8° |
| C7 | C6 | C3 | H12 | 114.0° | 93.4° |
| C6 | C7 | C4 | H11 | 118.4° | 143.5° |
| C7 | C6 | C8 | H47 | 129.1° | 103.5° |
| C7 | C6 | C8 | H46 | 108.8° | 135.7° |
| C8 | C6 | C7 | C10 | 2.7° | 26.1° |
| C6 | C8 | N9 | H47 | 119.0° | 119.6° |
| C6 | C8 | N9 | H46 | 119.0° | 119.7° |
| C6 | C8 | N9 | C10 | 20.8° | 1.2° |
| C8 | C6 | C3 | H12 | 3.1° | 11.2° |
| C8 | C6 | C7 | H13 | 123.3° | 102.4° |
| C6 | C8 | H47 | H46 | 122.9° | 120.8° |
| C6 | C8 | N9 | C1 | 156.4° | 178.9° |
| C7 | C10 | N9 | C8 | 22.7° | 18.2° |
| C7 | C10 | N9 | H48 | 119.1° | 119.3° |
| C7 | C10 | N9 | H49 | 119.1° | 119.3° |
| C7 | C10 | H48 | H49 | 122.6° | 121.4° |
| C10 | C7 | C4 | H11 | 9.7° | 39.9° |
| C10 | C7 | C6 | H14 | 129.0° | 154.7° |
| C7 | C10 | N9 | C1 | 51.7° | 161.9° |
| C8 | N9 | C10 | C1 | 74.4° | 179.9° |
| C8 | N9 | C10 | H48 | 96.4° | 101.1° |
| C8 | N9 | C10 | H49 | 141.8° | 137.5° |
| N9 | C8 | C6 | H14 | 115.8° | 145.2° |
| N9 | C8 | H47 | H46 | 122.9° | 120.8° |
| C8 | N9 | C1 | O1 | 90.0° | 4.5° |
| C8 | N9 | C1 | C11 | 90.0° | 175.5° |
| N9 | C10 | H48 | H49 | 122.5° | 121.4° |
| N9 | C10 | C7 | H13 | 111.1° | 102.4° |
| C10 | N9 | C8 | H47 | 139.8° | 120.7° |
| C10 | N9 | C8 | H46 | 98.2° | 118.5° |
| C10 | N9 | C1 | O1 | 90.0° | 175.4° |
| C10 | N9 | C1 | C11 | 90.0° | 4.6° |
| O16 | C15 | C28 | C29 | 141.6° | 41.8° |
| O16 | C15 | C28 | C31 | 43.2° | 138.5° |
| C15 | C28 | C29 | C31 | 174.8° | 179.7° |
| C15 | C28 | C29 | C30 | 171.8° | 180.0° |
| C15 | C28 | C31 | C32 | 172.6° | 180.0° |
| C15 | C28 | C29 | H54 | 8.2° | 0.0° |
| C15 | C28 | C31 | H56 | 7.4° | 0.0° |
| C28 | C29 | C30 | H54 | 180.0° | 180.0° |
| C28 | C29 | C30 | C33 | 0.7° | 0.0° |
| C29 | C28 | C31 | C32 | 2.6° | 0.2° |
| C28 | C29 | C30 | H55 | 179.3° | 180.0° |
| C29 | C28 | C31 | H56 | 177.4° | 179.7° |
| C31 | C28 | C29 | C30 | 3.0° | 0.3° |
| C28 | C31 | C32 | H56 | 180.0° | 180.0° |
| C28 | C31 | C32 | C33 | 0.0° | 0.1° |
| C28 | C31 | C32 | N34 | 177.2° | 180.0° |
| C31 | C28 | C29 | H54 | 177.0° | 179.7° |
| C29 | C30 | C33 | H55 | 180.0° | 180.0° |
| C29 | C30 | C33 | C32 | 1.8° | 0.3° |
| C29 | C30 | C33 | C36 | 175.8° | 180.0° |
| C30 | C33 | C32 | C31 | 2.2° | 0.3° |
| C30 | C33 | C32 | C36 | 178.2° | 179.8° |
| C30 | C33 | C32 | N34 | 179.9° | 179.7° |
| C30 | C33 | C36 | C35 | 178.9° | 179.5° |
| C30 | C33 | C36 | C37 | 0.1° | 0.0° |
| C33 | C30 | C29 | H54 | 179.3° | 180.0° |
| C31 | C32 | C33 | N34 | 177.7° | 180.0° |
| C31 | C32 | C33 | C36 | 175.9° | 179.9° |
| C31 | C32 | N34 | C35 | 175.7° | 180.0° |
| C31 | C32 | N34 | H57 | 4.3° | 0.0° |
| C33 | C32 | N34 | C35 | 1.8° | 0.0° |
| C32 | C33 | C36 | C35 | 1.0° | 0.2° |
| C32 | C33 | C36 | C37 | 177.7° | 179.8° |
| C32 | C33 | C30 | H55 | 178.1° | 179.7° |
| C33 | C32 | C31 | H56 | 180.0° | 180.0° |
| C33 | C32 | N34 | H57 | 178.2° | 180.0° |
| N34 | C32 | C33 | C36 | 1.8° | 0.1° |
| C32 | N34 | C35 | H57 | 180.0° | 180.0° |
| C32 | N34 | C35 | C36 | 1.1° | 0.1° |
| C32 | N34 | C35 | C40 | 177.7° | 179.9° |
| N34 | C32 | C31 | H56 | 2.8° | 0.0° |
| C33 | C36 | C35 | N34 | 0.0° | 0.2° |
| C33 | C36 | C35 | C37 | 178.9° | 179.6° |
| C33 | C36 | C35 | C40 | 178.9° | 179.9° |
| C33 | C36 | C37 | C38 | 178.0° | 180.0° |
| C36 | C33 | C30 | H55 | 4.3° | 0.0° |
| C33 | C36 | C37 | H58 | 2.0° | 0.0° |
| N34 | C35 | C36 | C40 | 178.9° | 179.9° |
| N34 | C35 | C36 | C37 | 179.0° | 179.8° |
| N34 | C35 | C40 | C39 | 178.4° | 179.4° |
| N34 | C35 | C40 | H60 | 1.6° | 0.1° |
| C35 | C36 | C37 | C38 | 0.6° | 0.5° |
| C36 | C35 | C40 | C39 | 0.3° | 0.5° |
| C36 | C35 | N34 | H57 | 178.9° | 179.9° |
| C35 | C36 | C37 | H58 | 179.4° | 179.5° |
| C36 | C35 | C40 | H60 | 179.6° | 179.8° |
| C40 | C35 | C36 | C37 | 0.0° | 0.2° |
| C35 | C40 | C39 | C38 | 0.1° | 1.0° |
| C35 | C40 | C39 | H60 | 180.0° | 179.3° |
| C40 | C35 | N34 | H57 | 2.3° | 0.0° |
| C35 | C40 | C39 | H59 | 179.9° | 179.8° |
| C36 | C37 | C38 | H58 | 180.0° | 180.0° |
| C36 | C37 | C38 | C39 | 0.9° | 0.0° |
| C36 | C37 | C38 | CL41 | 176.0° | 180.0° |
| C37 | C38 | C39 | CL41 | 176.8° | 180.0° |
| C37 | C38 | C39 | C40 | 0.6° | 0.7° |
| C37 | C38 | C39 | H59 | 179.4° | 180.0° |
| C38 | C39 | C40 | H59 | 180.0° | 179.2° |
| C39 | C38 | C37 | H58 | 179.1° | 180.0° |
| C38 | C39 | C40 | H60 | 179.9° | 179.7° |
| CL41 | C38 | C39 | C40 | 176.2° | 179.3° |
| CL41 | C38 | C37 | H58 | 4.0° | 0.0° |
| CL41 | C38 | C39 | H59 | 3.8° | 0.0° |
| H48 | C10 | C7 | H13 | 129.8° | 138.2° |
| H48 | C10 | N9 | C1 | 170.8° | 78.8° |
| H49 | C10 | C7 | H13 | 8.0° | 16.9° |
| H49 | C10 | N9 | C1 | 67.4° | 42.6° |
| H43 | C2 | C3 | H12 | 125.9° | 84.9° |
| H42 | C2 | C3 | H12 | 4.1° | 36.3° |
| H12 | C3 | C4 | H11 | 2.6° | 25.2° |
| H12 | C3 | C6 | H14 | 131.4° | 148.6° |
| H11 | C4 | C5 | H44 | 6.9° | 6.4° |
| H11 | C4 | C5 | H45 | 128.5° | 127.2° |
| H11 | C4 | C7 | H13 | 125.9° | 97.0° |
| H14 | C6 | C7 | H13 | 3.0° | 26.2° |
| H14 | C6 | C8 | H47 | 3.2° | 25.6° |
| H14 | C6 | C8 | H46 | 125.3° | 95.1° |
| H47 | C8 | N9 | C1 | 37.4° | 59.4° |
| H46 | C8 | N9 | C1 | 84.6° | 61.4° |
| H54 | C29 | C30 | H55 | 0.7° | 0.0° |
| H59 | C39 | C40 | H60 | 0.1° | 0.5° |
| N9 | C1 | O1 | C11 | 90.0° | 180.0° |
| N9 | C1 | C11 | C12 | 90.0° | 146.5° |
| N9 | C1 | C11 | C17 | 90.0° | 33.7° |
| O1 | C1 | C11 | C12 | 90.0° | 33.4° |
| O1 | C1 | C11 | C17 | 90.0° | 146.4° |
| C1 | C11 | C12 | C17 | 90.0° | 179.8° |
| C1 | C11 | C12 | C13 | 90.0° | 180.0° |
| C1 | C11 | C17 | C14 | 90.0° | 179.8° |
| C1 | C11 | C12 | H1 | 90.0° | 0.0° |
| C1 | C11 | C17 | H3 | 90.0° | 0.2° |
| C11 | C12 | C13 | H1 | 90.0° | 180.0° |
| C11 | C12 | C13 | C9 | 90.0° | 0.1° |
| C12 | C11 | C17 | C14 | 90.0° | 0.5° |
| C11 | C12 | C13 | H2 | 90.0° | 180.0° |
| C12 | C11 | C17 | H3 | 90.0° | 180.0° |
| C12 | C13 | C9 | H2 | 90.0° | 179.9° |
| C12 | C13 | C9 | C14 | 90.0° | 0.0° |
| C13 | C12 | C11 | C17 | 90.0° | 0.2° |
| C12 | C13 | C9 | N5 | 90.0° | 180.0° |
| C13 | C9 | C14 | N5 | 90.0° | 180.0° |
| C13 | C9 | C14 | C17 | 90.0° | 0.2° |
| C13 | C9 | C14 | N3 | 90.0° | 180.0° |
| C13 | C9 | N5 | N4 | 90.0° | 180.0° |
| C9 | C13 | C12 | H1 | 90.0° | 180.0° |
| C13 | C9 | N5 | H4 | 90.0° | 0.0° |
| C9 | C14 | C17 | N3 | 90.0° | 179.7° |
| C9 | C14 | C17 | C11 | 90.0° | 0.5° |
| C9 | C14 | N3 | N4 | 90.0° | 0.0° |
| C14 | C9 | N5 | N4 | 90.0° | 0.0° |
| C14 | C9 | C13 | H2 | 90.0° | 180.0° |
| C9 | C14 | C17 | H3 | 90.0° | 180.0° |
| C14 | C9 | N5 | H4 | 90.0° | 180.0° |
| C14 | C17 | C11 | H3 | 90.0° | 179.5° |
| C17 | C14 | N3 | N4 | 90.0° | 179.7° |
| C17 | C14 | C9 | N5 | 90.0° | 179.8° |
| C11 | C17 | C14 | N3 | 90.0° | 179.8° |
| C17 | C11 | C12 | H1 | 90.0° | 179.8° |
| C14 | N3 | N4 | N5 | 90.0° | 0.0° |
| N3 | C14 | C9 | N5 | 90.0° | 0.0° |
| N3 | C14 | C17 | H3 | 90.0° | 0.3° |
| N3 | N4 | N5 | C9 | 90.0° | 0.0° |
| N3 | N4 | N5 | H4 | 90.0° | 180.0° |
| N4 | N5 | C9 | H4 | 90.0° | 179.9° |
| N5 | C9 | C13 | H2 | 90.0° | 0.1° |
| H1 | C12 | C13 | H2 | 90.0° | 0.1° |
