NBW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N29 | C16 | sing | 1.47Å | 1.48Å | |
| N29 | C21 | sing | 1.47Å | 1.46Å | |
| N29 | C17 | sing | 1.47Å | 1.46Å | |
| C14 | C16 | sing | 1.53Å | 1.51Å | |
| C14 | C18 | sing | 1.53Å | 1.51Å | |
| C4 | N28 | sing | 1.36Å | 1.36Å | Aromatic |
| C4 | C7 | doub | 1.36Å | 1.38Å | Aromatic |
| C15 | C17 | sing | 1.53Å | 1.50Å | |
| C15 | C18 | sing | 1.53Å | 1.51Å | |
| C18 | N28 | sing | 1.47Å | 1.44Å | |
| N30 | C7 | sing | 1.41Å | 1.36Å | |
| N30 | C10 | sing | 1.38Å | 1.40Å | |
| N28 | N24 | sing | 1.40Å | 1.34Å | Aromatic |
| C7 | C3 | sing | 1.40Å | 1.41Å | Aromatic |
| N26 | C10 | doub | 1.32Å | 1.34Å | Aromatic |
| N26 | C5 | sing | 1.34Å | 1.34Å | Aromatic |
| C10 | N27 | sing | 1.33Å | 1.32Å | Aromatic |
| C1 | C5 | doub | 1.41Å | 1.37Å | Aromatic |
| C1 | C2 | sing | 1.37Å | 1.38Å | Aromatic |
| N24 | C3 | doub | 1.31Å | 1.33Å | Aromatic |
| C5 | C6 | sing | 1.42Å | 1.38Å | Aromatic |
| C2 | C8 | doub | 1.40Å | 1.37Å | Aromatic |
| N27 | C9 | doub | 1.32Å | 1.34Å | Aromatic |
| C6 | C9 | sing | 1.47Å | 1.37Å | Aromatic |
| C6 | N25 | doub | 1.32Å | 1.34Å | Aromatic |
| C9 | O33 | sing | 1.35Å | 1.39Å | |
| C8 | N25 | sing | 1.32Å | 1.33Å | Aromatic |
| C8 | C11 | sing | 1.48Å | 1.47Å | |
| O32 | C11 | doub | 1.22Å | 1.22Å | |
| C11 | N31 | sing | 1.35Å | 1.40Å | |
| O33 | C19 | sing | 1.43Å | 1.45Å | |
| C20 | C19 | sing | 1.53Å | 1.50Å | |
| C13 | C19 | sing | 1.53Å | 1.51Å | |
| C13 | C12 | sing | 1.53Å | 1.50Å | |
| C19 | C12 | sing | 1.53Å | 1.51Å | |
| N31 | C23 | sing | 1.46Å | 1.45Å | |
| N31 | C22 | sing | 1.47Å | 1.44Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C14 | H8 | sing | 1.09Å | 1.10Å | |
| C14 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C21 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C4 | H24 | sing | 1.08Å | 1.08Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C17 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C23 | H30 | sing | 1.09Å | 1.10Å | |
| N30 | H31 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | N29 | C21 | 106.0° | 111.0° |
| C16 | N29 | C17 | 114.5° | 111.2° |
| N29 | C16 | C14 | 111.8° | 109.5° |
| N29 | C16 | H12 | 108.9° | 109.5° |
| N29 | C16 | H13 | 108.9° | 109.5° |
| C21 | N29 | C17 | 105.0° | 111.0° |
| N29 | C21 | H17 | 109.5° | 109.6° |
| N29 | C21 | H18 | 109.5° | 109.4° |
| N29 | C21 | H19 | 109.5° | 109.5° |
| N29 | C17 | C15 | 114.2° | 109.5° |
| N29 | C17 | H25 | 108.3° | 109.5° |
| N29 | C17 | H26 | 108.3° | 109.5° |
| C16 | C14 | C18 | 104.8° | 109.3° |
| C16 | C14 | H8 | 110.6° | 109.5° |
| C16 | C14 | H9 | 110.6° | 109.5° |
| C14 | C16 | H12 | 108.9° | 109.4° |
| C14 | C16 | H13 | 108.9° | 109.4° |
| C14 | C18 | C15 | 113.8° | 109.2° |
| C14 | C18 | N28 | 118.2° | 109.5° |
| C18 | C14 | H8 | 110.7° | 109.5° |
| C18 | C14 | H9 | 110.6° | 109.5° |
| C14 | C18 | H27 | 102.1° | 109.5° |
| N28 | C4 | C7 | 104.3° | 107.6° |
| C4 | N28 | C18 | 128.8° | 126.0° |
| C4 | N28 | N24 | 114.9° | 107.9° |
| N28 | C4 | H24 | 127.8° | 126.2° |
| C4 | C7 | N30 | 126.7° | 126.1° |
| C4 | C7 | C3 | 105.7° | 107.8° |
| C7 | C4 | H24 | 127.8° | 126.2° |
| C17 | C15 | C18 | 109.3° | 109.3° |
| C17 | C15 | H10 | 109.5° | 109.6° |
| C17 | C15 | H11 | 109.5° | 109.5° |
| C15 | C17 | H25 | 108.3° | 109.4° |
| C15 | C17 | H26 | 108.3° | 109.5° |
| C15 | C18 | N28 | 114.8° | 109.6° |
| C18 | C15 | H10 | 109.5° | 109.5° |
| C18 | C15 | H11 | 109.5° | 109.4° |
| C15 | C18 | H27 | 102.1° | 109.5° |
| C18 | N28 | N24 | 116.2° | 126.1° |
| N28 | C18 | H27 | 102.7° | 109.6° |
| C7 | N30 | C10 | 126.0° | 120.0° |
| N30 | C7 | C3 | 127.5° | 126.1° |
| C7 | N30 | H31 | 117.0° | 120.0° |
| N30 | C10 | N26 | 120.0° | 118.3° |
| N30 | C10 | N27 | 117.3° | 118.3° |
| C10 | N30 | H31 | 117.0° | 120.0° |
| N28 | N24 | C3 | 103.3° | 108.4° |
| C7 | C3 | N24 | 111.7° | 108.3° |
| C7 | C3 | H3 | 124.1° | 125.9° |
| C10 | N26 | C5 | 118.4° | 120.9° |
| N26 | C10 | N27 | 122.7° | 123.4° |
| N26 | C5 | C1 | 121.3° | 122.1° |
| N26 | C5 | C6 | 122.3° | 118.9° |
| C10 | N27 | C9 | 117.8° | 121.4° |
| C5 | C1 | C2 | 119.8° | 118.1° |
| C1 | C5 | C6 | 116.4° | 119.0° |
| C5 | C1 | H1 | 120.1° | 121.0° |
| C1 | C2 | C8 | 118.8° | 119.9° |
| C2 | C1 | H1 | 120.1° | 120.9° |
| C1 | C2 | H2 | 120.6° | 120.1° |
| N24 | C3 | H3 | 124.2° | 125.8° |
| C5 | C6 | C9 | 114.7° | 117.6° |
| C5 | C6 | N25 | 125.5° | 120.5° |
| C2 | C8 | N25 | 123.4° | 121.4° |
| C2 | C8 | C11 | 119.2° | 119.3° |
| C8 | C2 | H2 | 120.6° | 120.0° |
| N27 | C9 | C6 | 124.1° | 117.8° |
| N27 | C9 | O33 | 121.0° | 121.1° |
| C9 | C6 | N25 | 119.7° | 122.0° |
| C6 | C9 | O33 | 114.8° | 121.1° |
| C6 | N25 | C8 | 116.0° | 121.1° |
| C9 | O33 | C19 | 115.6° | 117.0° |
| N25 | C8 | C11 | 117.3° | 119.3° |
| C8 | C11 | O32 | 114.2° | 120.0° |
| C8 | C11 | N31 | 121.2° | 120.1° |
| O32 | C11 | N31 | 124.4° | 120.0° |
| C11 | N31 | C23 | 127.0° | 120.0° |
| C11 | N31 | C22 | 118.8° | 120.0° |
| O33 | C19 | C20 | 116.2° | 115.6° |
| O33 | C19 | C13 | 118.3° | 117.5° |
| O33 | C19 | C12 | 112.7° | 117.5° |
| C20 | C19 | C13 | 120.1° | 117.5° |
| C20 | C19 | C12 | 117.3° | 117.5° |
| C19 | C20 | H14 | 109.5° | 109.5° |
| C19 | C20 | H15 | 109.4° | 109.4° |
| C19 | C20 | H16 | 109.5° | 109.4° |
| C19 | C13 | C12 | 60.0° | 60.0° |
| C13 | C19 | C12 | 59.8° | 60.0° |
| C19 | C13 | H6 | 120.0° | 117.5° |
| C19 | C13 | H7 | 120.0° | 117.5° |
| C13 | C12 | C19 | 60.2° | 60.0° |
| C13 | C12 | H4 | 120.0° | 117.5° |
| C13 | C12 | H5 | 120.0° | 117.6° |
| C12 | C13 | H6 | 120.0° | 117.4° |
| C12 | C13 | H7 | 120.0° | 117.5° |
| C19 | C12 | H4 | 120.0° | 117.5° |
| C19 | C12 | H5 | 120.0° | 117.5° |
| C23 | N31 | C22 | 113.6° | 120.0° |
| N31 | C23 | H28 | 109.5° | 109.5° |
| N31 | C23 | H29 | 109.5° | 109.5° |
| N31 | C23 | H30 | 109.5° | 109.5° |
| N31 | C22 | H20 | 109.5° | 109.5° |
| N31 | C22 | H21 | 109.5° | 109.5° |
| N31 | C22 | H22 | 109.5° | 109.4° |
| H4 | C12 | H5 | 109.5° | 115.5° |
| H6 | C13 | H7 | 109.5° | 115.6° |
| H8 | C14 | H9 | 109.5° | 109.5° |
| H10 | C15 | H11 | 109.5° | 109.5° |
| H12 | C16 | H13 | 109.5° | 109.5° |
| H14 | C20 | H15 | 109.5° | 109.5° |
| H14 | C20 | H16 | 109.4° | 109.4° |
| H15 | C20 | H16 | 109.5° | 109.5° |
| H17 | C21 | H18 | 109.5° | 109.4° |
| H17 | C21 | H19 | 109.5° | 109.5° |
| H18 | C21 | H19 | 109.5° | 109.4° |
| H20 | C22 | H21 | 109.4° | 109.5° |
| H20 | C22 | H22 | 109.5° | 109.5° |
| H21 | C22 | H22 | 109.5° | 109.5° |
| H25 | C17 | H26 | 109.5° | 109.4° |
| H28 | C23 | H29 | 109.4° | 109.4° |
| H28 | C23 | H30 | 109.4° | 109.4° |
| H29 | C23 | H30 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | N29 | C21 | C17 | 121.6° | 124.2° |
| N29 | C16 | C14 | H12 | 120.4° | 120.0° |
| N29 | C16 | C14 | H13 | 120.3° | 120.0° |
| N29 | C16 | C14 | C18 | 59.5° | 59.1° |
| C16 | N29 | C17 | C15 | 47.4° | 61.8° |
| N29 | C16 | C14 | H8 | 59.8° | 60.8° |
| N29 | C16 | C14 | H9 | 178.8° | 179.1° |
| N29 | C16 | H12 | H13 | 118.9° | 120.0° |
| C16 | N29 | C21 | H17 | 180.0° | 60.0° |
| C16 | N29 | C21 | H18 | 60.0° | 180.0° |
| C16 | N29 | C21 | H19 | 60.0° | 60.1° |
| C16 | N29 | C17 | H25 | 73.3° | 178.3° |
| C16 | N29 | C17 | H26 | 168.1° | 58.3° |
| C21 | N29 | C16 | C14 | 170.4° | 174.1° |
| C21 | N29 | C17 | C15 | 163.2° | 174.2° |
| C21 | N29 | C16 | H12 | 69.3° | 65.9° |
| C21 | N29 | C16 | H13 | 50.0° | 54.2° |
| N29 | C21 | H17 | H18 | 120.0° | 120.0° |
| N29 | C21 | H17 | H19 | 120.0° | 120.1° |
| N29 | C21 | H18 | H19 | 120.0° | 120.0° |
| C21 | N29 | C17 | H25 | 42.6° | 54.2° |
| C21 | N29 | C17 | H26 | 76.0° | 65.8° |
| C17 | N29 | C16 | C14 | 55.1° | 61.7° |
| N29 | C17 | C15 | H25 | 120.7° | 120.0° |
| N29 | C17 | C15 | H26 | 120.7° | 120.0° |
| N29 | C17 | C15 | C18 | 46.0° | 59.2° |
| N29 | C17 | C15 | H10 | 166.0° | 179.1° |
| N29 | C17 | C15 | H11 | 73.9° | 60.7° |
| C17 | N29 | C16 | H12 | 175.4° | 58.3° |
| C17 | N29 | C16 | H13 | 65.3° | 178.3° |
| C17 | N29 | C21 | H17 | 58.4° | 175.8° |
| C17 | N29 | C21 | H18 | 61.6° | 55.8° |
| C17 | N29 | C21 | H19 | 178.4° | 64.2° |
| N29 | C17 | H25 | H26 | 117.8° | 120.0° |
| C16 | C14 | C18 | H8 | 119.3° | 119.9° |
| C16 | C14 | C18 | H9 | 119.2° | 120.0° |
| C16 | C14 | C18 | C15 | 62.1° | 57.6° |
| C16 | C14 | C18 | N28 | 158.9° | 177.6° |
| C16 | C14 | H8 | H9 | 122.2° | 120.1° |
| C14 | C16 | H12 | H13 | 118.9° | 119.9° |
| C16 | C14 | C18 | H27 | 47.1° | 62.3° |
| C14 | C18 | N28 | C4 | 77.7° | 85.1° |
| C14 | C18 | C15 | C17 | 56.0° | 57.6° |
| C14 | C18 | C15 | N28 | 140.5° | 119.9° |
| C14 | C18 | C15 | H27 | 109.2° | 119.8° |
| C14 | C18 | N28 | H27 | 111.4° | 120.1° |
| C14 | C18 | N28 | N24 | 106.4° | 95.3° |
| C18 | C14 | H8 | H9 | 122.2° | 120.1° |
| C14 | C18 | C15 | H10 | 176.0° | 177.6° |
| C14 | C18 | C15 | H11 | 64.0° | 62.3° |
| C18 | C14 | C16 | H12 | 179.9° | 60.9° |
| C18 | C14 | C16 | H13 | 60.8° | 179.1° |
| N28 | C4 | C7 | H24 | 180.0° | 179.6° |
| C4 | N28 | C18 | C15 | 61.0° | 34.6° |
| C4 | N28 | C18 | N24 | 175.9° | 179.6° |
| N28 | C4 | C7 | N30 | 179.2° | 180.0° |
| N28 | C4 | C7 | C3 | 0.3° | 0.1° |
| C4 | N28 | N24 | C3 | 0.8° | 0.5° |
| C4 | N28 | C18 | H27 | 171.0° | 154.8° |
| C7 | C4 | N28 | C18 | 176.2° | 180.0° |
| C4 | C7 | N30 | C3 | 178.6° | 179.9° |
| C4 | C7 | N30 | C10 | 162.4° | 180.0° |
| C7 | C4 | N28 | N24 | 0.3° | 0.3° |
| C4 | C7 | C3 | N24 | 0.9° | 0.2° |
| C4 | C7 | C3 | H3 | 179.1° | 179.9° |
| C4 | C7 | N30 | H31 | 17.6° | 0.1° |
| C17 | C15 | C18 | H10 | 120.0° | 120.0° |
| C17 | C15 | C18 | H11 | 120.0° | 120.0° |
| C17 | C15 | C18 | N28 | 163.5° | 177.5° |
| C17 | C15 | H10 | H11 | 120.1° | 120.2° |
| C15 | C17 | H25 | H26 | 117.9° | 119.9° |
| C17 | C15 | C18 | H27 | 53.2° | 62.2° |
| C15 | C18 | N28 | H27 | 109.9° | 120.2° |
| C15 | C18 | N28 | N24 | 114.9° | 145.0° |
| C15 | C18 | C14 | H8 | 57.2° | 62.3° |
| C15 | C18 | C14 | H9 | 178.7° | 177.6° |
| C18 | C15 | H10 | H11 | 120.1° | 120.0° |
| C18 | C15 | C17 | H25 | 74.6° | 179.2° |
| C18 | C15 | C17 | H26 | 166.7° | 60.9° |
| C18 | N28 | N24 | C3 | 177.3° | 179.9° |
| N28 | C18 | C14 | H8 | 81.9° | 57.7° |
| N28 | C18 | C14 | H9 | 39.6° | 62.4° |
| N28 | C18 | C15 | H10 | 43.5° | 62.5° |
| N28 | C18 | C15 | H11 | 76.6° | 57.6° |
| C18 | N28 | C4 | H24 | 3.8° | 0.4° |
| C7 | N30 | C10 | H31 | 180.0° | 179.9° |
| C7 | N30 | C10 | N26 | 172.7° | 0.1° |
| C7 | N30 | C10 | N27 | 7.7° | 180.0° |
| N30 | C7 | C3 | N24 | 179.7° | 179.7° |
| N30 | C7 | C3 | H3 | 0.3° | 0.0° |
| N30 | C7 | C4 | H24 | 0.8° | 0.4° |
| C10 | N30 | C7 | C3 | 19.0° | 0.1° |
| N30 | C10 | N26 | N27 | 179.5° | 179.9° |
| N30 | C10 | N26 | C5 | 179.6° | 180.0° |
| N30 | C10 | N27 | C9 | 179.9° | 180.0° |
| N28 | N24 | C3 | C7 | 1.0° | 0.4° |
| N28 | N24 | C3 | H3 | 179.0° | 179.9° |
| N24 | N28 | C4 | H24 | 179.7° | 179.9° |
| N24 | N28 | C18 | H27 | 4.9° | 24.8° |
| C7 | C3 | N24 | H3 | 180.0° | 179.7° |
| C3 | C7 | C4 | H24 | 179.6° | 179.7° |
| C3 | C7 | N30 | H31 | 161.0° | 180.0° |
| C10 | N26 | C5 | C1 | 177.6° | 180.0° |
| C10 | N26 | C5 | C6 | 1.5° | 0.1° |
| N26 | C10 | N27 | C9 | 0.4° | 0.1° |
| N26 | C10 | N30 | H31 | 7.3° | 180.0° |
| C5 | N26 | C10 | N27 | 0.8° | 0.1° |
| N26 | C5 | C1 | C6 | 179.2° | 179.9° |
| N26 | C5 | C1 | C2 | 179.3° | 179.9° |
| N26 | C5 | C6 | C9 | 1.6° | 0.0° |
| N26 | C5 | C6 | N25 | 179.0° | 179.9° |
| N26 | C5 | C1 | H1 | 0.7° | 0.2° |
| C10 | N27 | C9 | C6 | 0.5° | 0.0° |
| C10 | N27 | C9 | O33 | 178.3° | 180.0° |
| N27 | C10 | N30 | H31 | 172.2° | 0.1° |
| C5 | C1 | C2 | H1 | 180.0° | 179.7° |
| C5 | C1 | C2 | C8 | 1.4° | 0.0° |
| C1 | C5 | C6 | C9 | 177.6° | 180.0° |
| C1 | C5 | C6 | N25 | 0.2° | 0.0° |
| C5 | C1 | C2 | H2 | 178.6° | 180.0° |
| C2 | C1 | C5 | C6 | 0.1° | 0.0° |
| C1 | C2 | C8 | H2 | 180.0° | 180.0° |
| C1 | C2 | C8 | N25 | 3.3° | 0.1° |
| C1 | C2 | C8 | C11 | 177.8° | 180.0° |
| C5 | C6 | C9 | N27 | 1.1° | 0.0° |
| C5 | C6 | C9 | N25 | 177.6° | 180.0° |
| C5 | C6 | C9 | O33 | 177.8° | 180.0° |
| C5 | C6 | N25 | C8 | 1.9° | 0.0° |
| C6 | C5 | C1 | H1 | 179.9° | 179.7° |
| C2 | C8 | N25 | C6 | 3.5° | 0.1° |
| C2 | C8 | N25 | C11 | 174.6° | 179.9° |
| C2 | C8 | C11 | O32 | 39.4° | 7.5° |
| C2 | C8 | C11 | N31 | 144.7° | 172.6° |
| C8 | C2 | C1 | H1 | 178.6° | 179.7° |
| N27 | C9 | C6 | O33 | 178.9° | 180.0° |
| N27 | C9 | C6 | N25 | 178.7° | 179.9° |
| N27 | C9 | O33 | C19 | 9.6° | 4.7° |
| C9 | C6 | N25 | C8 | 179.2° | 180.0° |
| C6 | C9 | O33 | C19 | 169.3° | 175.4° |
| N25 | C6 | C9 | O33 | 0.2° | 0.0° |
| C6 | N25 | C8 | C11 | 178.1° | 180.0° |
| C9 | O33 | C19 | C20 | 67.5° | 89.3° |
| C9 | O33 | C19 | C13 | 86.3° | 56.3° |
| C9 | O33 | C19 | C12 | 153.1° | 124.9° |
| N25 | C8 | C11 | O32 | 135.4° | 172.6° |
| N25 | C8 | C11 | N31 | 40.5° | 7.3° |
| N25 | C8 | C2 | H2 | 176.7° | 180.0° |
| C8 | C11 | O32 | N31 | 175.7° | 180.0° |
| C8 | C11 | N31 | C23 | 21.6° | 178.0° |
| C8 | C11 | N31 | C22 | 168.5° | 2.1° |
| C11 | C8 | C2 | H2 | 2.1° | 0.1° |
| O32 | C11 | N31 | C23 | 162.9° | 2.1° |
| O32 | C11 | N31 | C22 | 7.0° | 177.9° |
| C11 | N31 | C23 | C22 | 170.3° | 180.0° |
| C11 | N31 | C22 | H20 | 180.0° | 83.7° |
| C11 | N31 | C22 | H21 | 60.0° | 156.3° |
| C11 | N31 | C22 | H22 | 60.0° | 36.3° |
| C11 | N31 | C23 | H28 | 180.0° | 90.0° |
| C11 | N31 | C23 | H29 | 60.0° | 150.0° |
| C11 | N31 | C23 | H30 | 60.0° | 30.0° |
| O33 | C19 | C20 | C13 | 153.3° | 145.6° |
| O33 | C19 | C20 | C12 | 137.5° | 145.8° |
| O33 | C19 | C13 | C12 | 101.2° | 107.6° |
| O33 | C19 | C12 | H4 | 1.0° | 0.1° |
| O33 | C19 | C12 | H5 | 140.0° | 145.0° |
| O33 | C19 | C13 | H6 | 8.3° | 145.0° |
| O33 | C19 | C13 | H7 | 149.3° | 0.1° |
| O33 | C19 | C20 | H14 | 180.0° | 90.6° |
| O33 | C19 | C20 | H15 | 60.0° | 29.4° |
| O33 | C19 | C20 | H16 | 60.0° | 149.4° |
| C20 | C19 | C13 | C12 | 106.1° | 107.5° |
| C20 | C19 | C12 | H4 | 139.9° | 145.1° |
| C20 | C19 | C12 | H5 | 1.1° | 0.1° |
| C20 | C19 | C13 | H6 | 144.5° | 0.1° |
| C20 | C19 | C13 | H7 | 3.4° | 145.0° |
| C19 | C20 | H14 | H15 | 120.0° | 120.0° |
| C19 | C20 | H14 | H16 | 120.0° | 120.0° |
| C19 | C20 | H15 | H16 | 120.0° | 120.0° |
| C19 | C13 | C12 | H6 | 109.5° | 107.5° |
| C19 | C13 | C12 | H7 | 109.5° | 107.5° |
| C19 | C13 | C12 | H4 | 109.5° | 107.5° |
| C19 | C13 | C12 | H5 | 109.5° | 107.5° |
| C19 | C13 | H6 | H7 | 144.7° | 145.8° |
| C13 | C19 | C20 | H14 | 26.7° | 55.0° |
| C13 | C19 | C20 | H15 | 93.3° | 175.0° |
| C13 | C19 | C20 | H16 | 146.7° | 65.0° |
| C13 | C12 | H4 | H5 | 144.7° | 145.7° |
| C12 | C13 | H6 | H7 | 144.7° | 145.6° |
| C19 | C12 | H4 | H5 | 144.6° | 145.6° |
| C12 | C19 | C20 | H14 | 42.5° | 123.6° |
| C12 | C19 | C20 | H15 | 162.5° | 116.4° |
| C12 | C19 | C20 | H16 | 77.5° | 3.6° |
| C23 | N31 | C22 | H20 | 8.8° | 96.3° |
| C23 | N31 | C22 | H21 | 128.8° | 23.7° |
| C23 | N31 | C22 | H22 | 111.2° | 143.7° |
| N31 | C23 | H28 | H29 | 120.0° | 120.1° |
| N31 | C23 | H28 | H30 | 120.0° | 120.0° |
| N31 | C23 | H29 | H30 | 120.0° | 120.0° |
| N31 | C22 | H20 | H21 | 120.0° | 120.0° |
| N31 | C22 | H20 | H22 | 120.0° | 120.0° |
| N31 | C22 | H21 | H22 | 120.0° | 120.0° |
| C22 | N31 | C23 | H28 | 9.6° | 90.0° |
| C22 | N31 | C23 | H29 | 110.4° | 30.0° |
| C22 | N31 | C23 | H30 | 129.7° | 150.0° |
| H1 | C1 | C2 | H2 | 1.4° | 0.3° |
| H4 | C12 | C13 | H6 | 0.0° | 145.0° |
| H4 | C12 | C13 | H7 | 141.0° | 0.1° |
| H5 | C12 | C13 | H6 | 141.0° | 0.0° |
| H5 | C12 | C13 | H7 | 0.1° | 145.0° |
| H8 | C14 | C16 | H12 | 60.6° | 179.2° |
| H8 | C14 | C16 | H13 | 179.9° | 59.2° |
| H8 | C14 | C18 | H27 | 166.4° | 177.8° |
| H9 | C14 | C16 | H12 | 60.9° | 59.1° |
| H9 | C14 | C16 | H13 | 58.4° | 60.9° |
| H9 | C14 | C18 | H27 | 72.1° | 57.7° |
| H10 | C15 | C17 | H25 | 45.3° | 60.8° |
| H10 | C15 | C17 | H26 | 73.3° | 59.1° |
| H10 | C15 | C18 | H27 | 66.8° | 57.8° |
| H11 | C15 | C17 | H25 | 165.4° | 59.3° |
| H11 | C15 | C17 | H26 | 46.8° | 179.3° |
| H11 | C15 | C18 | H27 | 173.2° | 177.8° |
| H14 | C20 | H15 | H16 | 120.0° | 120.0° |
| H17 | C21 | H18 | H19 | 120.0° | 120.0° |
| H20 | C22 | H21 | H22 | 120.0° | 120.0° |
| H28 | C23 | H29 | H30 | 120.0° | 119.9° |
