ULY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | O23 | sing | 1.43Å | 1.43Å | |
| O23 | C22 | sing | 1.36Å | 1.37Å | |
| N01 | C02 | sing | 1.34Å | 1.34Å | Aromatic |
| N01 | C04 | doub | 1.32Å | 1.33Å | Aromatic |
| C22 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| C22 | C17 | sing | 1.40Å | 1.41Å | Aromatic |
| C02 | C03 | doub | 1.35Å | 1.38Å | Aromatic |
| C21 | C20 | sing | 1.40Å | 1.39Å | Aromatic |
| N11 | C04 | sing | 1.38Å | 1.34Å | |
| F35 | C34 | sing | 1.40Å | 1.33Å | |
| C04 | C05 | sing | 1.41Å | 1.43Å | Aromatic |
| F36 | C34 | sing | 1.40Å | 1.33Å | |
| O26 | C25 | doub | 1.22Å | 1.23Å | |
| C03 | N06 | sing | 1.37Å | 1.37Å | Aromatic |
| C05 | N06 | sing | 1.38Å | 1.40Å | Aromatic |
| C05 | C09 | doub | 1.39Å | 1.38Å | Aromatic |
| N06 | C07 | sing | 1.35Å | 1.36Å | Aromatic |
| C34 | F37 | sing | 1.40Å | 1.33Å | |
| C34 | C32 | sing | 1.51Å | 1.50Å | |
| C09 | C17 | sing | 1.48Å | 1.47Å | |
| C09 | N08 | sing | 1.34Å | 1.38Å | Aromatic |
| C17 | C18 | doub | 1.40Å | 1.40Å | Aromatic |
| C12 | C10 | sing | 1.53Å | 1.53Å | |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C07 | N08 | doub | 1.31Å | 1.35Å | Aromatic |
| C07 | C10 | sing | 1.51Å | 1.49Å | |
| C25 | C20 | sing | 1.48Å | 1.49Å | |
| C25 | N27 | sing | 1.35Å | 1.36Å | |
| C20 | C19 | doub | 1.40Å | 1.39Å | Aromatic |
| C10 | C16 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C33 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C28 | sing | 1.39Å | 1.40Å | Aromatic |
| C32 | C31 | sing | 1.39Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| N27 | C28 | sing | 1.39Å | 1.40Å | |
| C28 | N29 | doub | 1.32Å | 1.35Å | Aromatic |
| C16 | N15 | sing | 1.47Å | 1.46Å | |
| C14 | N15 | sing | 1.48Å | 1.47Å | |
| C14 | C40 | sing | 1.54Å | 1.54Å | |
| C31 | C30 | doub | 1.38Å | 1.38Å | Aromatic |
| N15 | C38 | sing | 1.34Å | 1.35Å | |
| C40 | C39 | sing | 1.55Å | 1.53Å | |
| C38 | C39 | sing | 1.51Å | 1.51Å | |
| C38 | O41 | doub | 1.21Å | 1.22Å | |
| N29 | C30 | sing | 1.32Å | 1.34Å | Aromatic |
| C02 | H1 | sing | 1.08Å | 1.08Å | |
| C03 | H2 | sing | 1.08Å | 1.08Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| N11 | H4 | sing | 0.97Å | 1.00Å | |
| N11 | H5 | sing | 0.97Å | 1.00Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C14 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.08Å | 1.08Å | |
| C19 | H14 | sing | 1.08Å | 1.08Å | |
| C21 | H15 | sing | 1.08Å | 1.08Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| N27 | H19 | sing | 0.97Å | 1.00Å | |
| C30 | H20 | sing | 1.08Å | 1.08Å | |
| C31 | H21 | sing | 1.08Å | 1.08Å | |
| C33 | H22 | sing | 1.08Å | 1.08Å | |
| C39 | H23 | sing | 1.09Å | 1.10Å | |
| C40 | H24 | sing | 1.09Å | 1.10Å | |
| C39 | H25 | sing | 1.09Å | 1.10Å | |
| C40 | H26 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | O23 | C22 | 118.0° | 117.0° |
| O23 | C24 | H16 | 109.5° | 109.4° |
| O23 | C24 | H17 | 109.5° | 109.5° |
| O23 | C24 | H18 | 109.5° | 109.5° |
| O23 | C22 | C21 | 123.3° | 120.1° |
| O23 | C22 | C17 | 116.0° | 120.1° |
| C02 | N01 | C04 | 119.3° | 121.3° |
| N01 | C02 | C03 | 124.0° | 121.6° |
| N01 | C02 | H1 | 118.0° | 119.2° |
| N01 | C04 | N11 | 117.9° | 120.3° |
| N01 | C04 | C05 | 120.3° | 119.4° |
| C21 | C22 | C17 | 120.7° | 119.9° |
| C22 | C21 | C20 | 120.2° | 119.9° |
| C22 | C21 | H15 | 119.9° | 120.0° |
| C22 | C17 | C09 | 122.9° | 120.0° |
| C22 | C17 | C18 | 118.5° | 120.0° |
| C02 | C03 | N06 | 117.5° | 119.9° |
| C03 | C02 | H1 | 118.0° | 119.2° |
| C02 | C03 | H2 | 121.2° | 120.1° |
| C21 | C20 | C25 | 115.1° | 120.0° |
| C21 | C20 | C19 | 119.4° | 120.1° |
| C20 | C21 | H15 | 119.9° | 120.1° |
| N11 | C04 | C05 | 121.7° | 120.3° |
| C04 | N11 | H4 | 109.5° | 120.1° |
| C04 | N11 | H5 | 109.5° | 120.0° |
| F35 | C34 | F36 | 105.4° | 109.5° |
| F35 | C34 | F37 | 104.4° | 109.4° |
| F35 | C34 | C32 | 113.2° | 109.5° |
| C04 | C05 | N06 | 118.5° | 119.2° |
| C04 | C05 | C09 | 136.0° | 134.6° |
| F36 | C34 | F37 | 106.5° | 109.5° |
| F36 | C34 | C32 | 113.0° | 109.5° |
| O26 | C25 | C20 | 120.1° | 120.0° |
| O26 | C25 | N27 | 123.5° | 120.0° |
| C03 | N06 | C05 | 120.3° | 118.7° |
| C03 | N06 | C07 | 132.5° | 134.1° |
| N06 | C03 | H2 | 121.3° | 120.0° |
| N06 | C05 | C09 | 105.5° | 106.2° |
| C05 | N06 | C07 | 107.2° | 107.2° |
| C05 | C09 | C17 | 130.4° | 126.5° |
| C05 | C09 | N08 | 110.5° | 107.0° |
| N06 | C07 | N08 | 111.3° | 109.8° |
| N06 | C07 | C10 | 123.4° | 125.1° |
| F37 | C34 | C32 | 113.6° | 109.5° |
| C34 | C32 | C33 | 120.1° | 120.7° |
| C34 | C32 | C31 | 121.4° | 120.8° |
| C17 | C09 | N08 | 119.1° | 126.5° |
| C09 | C17 | C18 | 118.6° | 120.0° |
| C09 | N08 | C07 | 105.5° | 109.8° |
| C17 | C18 | C19 | 120.6° | 120.0° |
| C17 | C18 | H13 | 119.7° | 120.0° |
| C10 | C12 | C13 | 110.9° | 112.3° |
| C12 | C10 | C07 | 112.2° | 109.2° |
| C12 | C10 | C16 | 109.7° | 111.0° |
| C12 | C10 | H3 | 108.9° | 109.1° |
| C10 | C12 | H6 | 109.1° | 108.9° |
| C10 | C12 | H7 | 109.1° | 108.9° |
| C12 | C13 | C14 | 109.4° | 109.6° |
| C13 | C12 | H6 | 109.1° | 108.9° |
| C13 | C12 | H7 | 109.1° | 108.9° |
| C12 | C13 | H8 | 109.5° | 109.5° |
| C12 | C13 | H9 | 109.5° | 109.4° |
| N08 | C07 | C10 | 125.2° | 125.1° |
| C07 | C10 | C16 | 107.6° | 109.2° |
| C07 | C10 | H3 | 109.5° | 109.2° |
| C20 | C25 | N27 | 116.3° | 120.0° |
| C25 | C20 | C19 | 125.4° | 120.0° |
| C25 | N27 | C28 | 127.8° | 120.0° |
| C25 | N27 | H19 | 116.1° | 119.9° |
| C20 | C19 | C18 | 120.6° | 120.1° |
| C20 | C19 | H14 | 119.7° | 120.0° |
| C10 | C16 | N15 | 110.2° | 107.4° |
| C16 | C10 | H3 | 108.9° | 109.2° |
| C10 | C16 | H11 | 109.3° | 109.8° |
| C10 | C16 | H12 | 109.3° | 109.9° |
| C13 | C14 | N15 | 109.9° | 106.8° |
| C13 | C14 | C40 | 117.7° | 110.9° |
| C14 | C13 | H8 | 109.5° | 109.4° |
| C14 | C13 | H9 | 109.5° | 109.5° |
| C13 | C14 | H10 | 108.4° | 111.1° |
| C32 | C33 | C28 | 118.7° | 119.1° |
| C33 | C32 | C31 | 118.5° | 118.5° |
| C32 | C33 | H22 | 120.6° | 120.5° |
| C33 | C28 | N27 | 122.4° | 119.7° |
| C33 | C28 | N29 | 122.8° | 120.6° |
| C28 | C33 | H22 | 120.6° | 120.4° |
| C32 | C31 | C30 | 119.2° | 119.3° |
| C32 | C31 | H21 | 120.4° | 120.3° |
| C19 | C18 | H13 | 119.8° | 119.9° |
| C18 | C19 | H14 | 119.7° | 120.0° |
| N27 | C28 | N29 | 114.8° | 119.7° |
| C28 | N27 | H19 | 116.1° | 120.1° |
| C28 | N29 | C30 | 117.4° | 121.7° |
| C16 | N15 | C14 | 117.6° | 121.1° |
| C16 | N15 | C38 | 126.6° | 127.8° |
| N15 | C16 | H11 | 109.3° | 109.9° |
| N15 | C16 | H12 | 109.3° | 109.9° |
| N15 | C14 | C40 | 103.4° | 104.9° |
| C14 | N15 | C38 | 115.2° | 111.0° |
| N15 | C14 | H10 | 109.0° | 111.2° |
| C14 | C40 | C39 | 106.2° | 101.5° |
| C40 | C14 | H10 | 108.2° | 111.7° |
| C14 | C40 | H24 | 110.3° | 111.0° |
| C14 | C40 | H26 | 110.3° | 111.0° |
| C31 | C30 | N29 | 123.5° | 120.8° |
| C31 | C30 | H20 | 118.3° | 119.6° |
| C30 | C31 | H21 | 120.4° | 120.4° |
| N15 | C38 | C39 | 108.4° | 110.1° |
| N15 | C38 | O41 | 125.0° | 124.9° |
| C40 | C39 | C38 | 105.8° | 104.3° |
| C40 | C39 | H23 | 110.4° | 110.4° |
| C39 | C40 | H24 | 110.3° | 111.0° |
| C40 | C39 | H25 | 110.4° | 110.5° |
| C39 | C40 | H26 | 110.3° | 111.0° |
| C39 | C38 | O41 | 126.5° | 124.9° |
| C38 | C39 | H23 | 110.4° | 110.5° |
| C38 | C39 | H25 | 110.4° | 110.5° |
| N29 | C30 | H20 | 118.2° | 119.6° |
| H4 | N11 | H5 | 109.4° | 119.9° |
| H6 | C12 | H7 | 109.5° | 108.9° |
| H8 | C13 | H9 | 109.5° | 109.4° |
| H11 | C16 | H12 | 109.5° | 109.9° |
| H16 | C24 | H17 | 109.4° | 109.4° |
| H16 | C24 | H18 | 109.5° | 109.4° |
| H17 | C24 | H18 | 109.4° | 109.5° |
| H23 | C39 | H25 | 109.5° | 110.4° |
| H24 | C40 | H26 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | O23 | C22 | C21 | 2.4° | 0.0° |
| C24 | O23 | C22 | C17 | 178.5° | 179.5° |
| O23 | C24 | H16 | H17 | 120.1° | 120.0° |
| O23 | C24 | H16 | H18 | 120.0° | 120.0° |
| O23 | C24 | H17 | H18 | 120.0° | 120.1° |
| O23 | C22 | C21 | C17 | 179.1° | 179.5° |
| O23 | C22 | C21 | C20 | 178.7° | 180.0° |
| O23 | C22 | C17 | C09 | 0.2° | 0.2° |
| O23 | C22 | C17 | C18 | 179.8° | 179.9° |
| O23 | C22 | C21 | H15 | 1.2° | 0.2° |
| C22 | O23 | C24 | H16 | 180.0° | 60.0° |
| C22 | O23 | C24 | H17 | 60.0° | 59.9° |
| C22 | O23 | C24 | H18 | 60.0° | 179.9° |
| N01 | C02 | C03 | H1 | 180.0° | 180.0° |
| C02 | N01 | C04 | N11 | 177.3° | 180.0° |
| C02 | N01 | C04 | C05 | 1.4° | 0.1° |
| N01 | C02 | C03 | N06 | 0.7° | 0.0° |
| N01 | C02 | C03 | H2 | 179.3° | 180.0° |
| C04 | N01 | C02 | C03 | 0.7° | 0.1° |
| N01 | C04 | N11 | C05 | 178.7° | 179.9° |
| N01 | C04 | C05 | N06 | 0.7° | 0.1° |
| N01 | C04 | C05 | C09 | 176.9° | 180.0° |
| C04 | N01 | C02 | H1 | 179.2° | 180.0° |
| N01 | C04 | N11 | H4 | 0.0° | 2.4° |
| N01 | C04 | N11 | H5 | 120.0° | 177.6° |
| C22 | C21 | C20 | H15 | 180.0° | 179.8° |
| C21 | C22 | C17 | C09 | 179.3° | 179.7° |
| C21 | C22 | C17 | C18 | 0.7° | 0.6° |
| C22 | C21 | C20 | C25 | 179.3° | 179.8° |
| C22 | C21 | C20 | C19 | 1.2° | 0.2° |
| C17 | C22 | C21 | C20 | 0.3° | 0.5° |
| C22 | C17 | C09 | C05 | 64.5° | 122.0° |
| C22 | C17 | C09 | C18 | 180.0° | 179.7° |
| C22 | C17 | C09 | N08 | 115.9° | 58.0° |
| C22 | C17 | C18 | C19 | 0.7° | 0.3° |
| C22 | C17 | C18 | H13 | 179.3° | 179.8° |
| C17 | C22 | C21 | H15 | 179.7° | 179.7° |
| C02 | C03 | N06 | H2 | 180.0° | 180.0° |
| C02 | C03 | N06 | C05 | 1.3° | 0.0° |
| C02 | C03 | N06 | C07 | 177.2° | 180.0° |
| C21 | C20 | C25 | O26 | 29.3° | 0.0° |
| C21 | C20 | C25 | C19 | 177.9° | 180.0° |
| C21 | C20 | C25 | N27 | 149.0° | 180.0° |
| C21 | C20 | C19 | C18 | 1.2° | 0.1° |
| C21 | C20 | C19 | H14 | 178.8° | 180.0° |
| N11 | C04 | C05 | N06 | 178.0° | 180.0° |
| N11 | C04 | C05 | C09 | 4.4° | 0.1° |
| C04 | N11 | H4 | H5 | 120.0° | 180.0° |
| F35 | C34 | F36 | F37 | 110.5° | 120.0° |
| F35 | C34 | F36 | C32 | 124.1° | 120.0° |
| F35 | C34 | F37 | C32 | 123.7° | 120.0° |
| F35 | C34 | C32 | C33 | 24.4° | 59.8° |
| F35 | C34 | C32 | C31 | 155.5° | 120.0° |
| C04 | C05 | N06 | C03 | 0.7° | 0.0° |
| C04 | C05 | N06 | C09 | 178.3° | 179.9° |
| C04 | C05 | N06 | C07 | 178.2° | 180.0° |
| C04 | C05 | C09 | C17 | 1.9° | 0.1° |
| C04 | C05 | C09 | N08 | 178.4° | 179.9° |
| C05 | C04 | N11 | H4 | 178.7° | 177.5° |
| C05 | C04 | N11 | H5 | 61.3° | 2.5° |
| F36 | C34 | F37 | C32 | 125.0° | 120.0° |
| F36 | C34 | C32 | C33 | 95.3° | 60.2° |
| F36 | C34 | C32 | C31 | 84.8° | 120.0° |
| O26 | C25 | C20 | N27 | 178.3° | 179.9° |
| O26 | C25 | C20 | C19 | 148.6° | 180.0° |
| O26 | C25 | N27 | C28 | 1.0° | 5.1° |
| O26 | C25 | N27 | H19 | 179.0° | 175.1° |
| C03 | N06 | C05 | C07 | 178.8° | 180.0° |
| C03 | N06 | C05 | C09 | 179.0° | 180.0° |
| C03 | N06 | C07 | N08 | 179.5° | 180.0° |
| C03 | N06 | C07 | C10 | 3.0° | 0.0° |
| N06 | C03 | C02 | H1 | 179.4° | 180.0° |
| N06 | C05 | C09 | C17 | 179.8° | 180.0° |
| N06 | C05 | C09 | N08 | 0.6° | 0.0° |
| C05 | N06 | C07 | N08 | 0.9° | 0.0° |
| C05 | N06 | C07 | C10 | 178.4° | 180.0° |
| C05 | N06 | C03 | H2 | 178.7° | 180.0° |
| C09 | C05 | N06 | C07 | 0.1° | 0.0° |
| C05 | C09 | C17 | N08 | 179.6° | 179.9° |
| C05 | C09 | C17 | C18 | 115.4° | 58.3° |
| C05 | C09 | N08 | C07 | 1.1° | 0.0° |
| N06 | C07 | N08 | C09 | 1.2° | 0.0° |
| N06 | C07 | C10 | C12 | 149.4° | 118.5° |
| N06 | C07 | N08 | C10 | 177.5° | 180.0° |
| N06 | C07 | C10 | C16 | 89.9° | 120.0° |
| C07 | N06 | C03 | H2 | 2.9° | 0.0° |
| N06 | C07 | C10 | H3 | 28.4° | 0.7° |
| F37 | C34 | C32 | C33 | 143.2° | 179.7° |
| F37 | C34 | C32 | C31 | 36.7° | 0.0° |
| C34 | C32 | C33 | C31 | 179.9° | 179.8° |
| C34 | C32 | C33 | C28 | 179.0° | 179.7° |
| C34 | C32 | C31 | C30 | 179.2° | 180.0° |
| C34 | C32 | C31 | H21 | 0.8° | 0.0° |
| C34 | C32 | C33 | H22 | 1.0° | 0.2° |
| C17 | C09 | N08 | C07 | 179.2° | 179.9° |
| C09 | C17 | C18 | C19 | 179.3° | 180.0° |
| C09 | C17 | C18 | H13 | 0.8° | 0.1° |
| N08 | C09 | C17 | C18 | 64.1° | 121.7° |
| C09 | N08 | C07 | C10 | 178.7° | 180.0° |
| C17 | C18 | C19 | C20 | 0.2° | 0.0° |
| C17 | C18 | C19 | H13 | 180.0° | 179.9° |
| C17 | C18 | C19 | H14 | 179.8° | 179.9° |
| C10 | C12 | C13 | H6 | 120.2° | 120.7° |
| C10 | C12 | C13 | H7 | 120.2° | 120.7° |
| C12 | C10 | C07 | N08 | 33.5° | 61.5° |
| C12 | C10 | C07 | C16 | 120.8° | 121.5° |
| C12 | C10 | C07 | H3 | 121.0° | 119.2° |
| C12 | C10 | C16 | H3 | 119.1° | 120.3° |
| C10 | C12 | C13 | C14 | 58.9° | 67.0° |
| C12 | C10 | C16 | N15 | 52.4° | 18.1° |
| C10 | C12 | H6 | H7 | 119.3° | 118.6° |
| C10 | C12 | C13 | H8 | 178.9° | 53.0° |
| C10 | C12 | C13 | H9 | 61.0° | 172.9° |
| C12 | C10 | C16 | H11 | 172.6° | 137.5° |
| C12 | C10 | C16 | H12 | 67.7° | 101.4° |
| C13 | C12 | C10 | C07 | 177.3° | 79.7° |
| C13 | C12 | C10 | C16 | 57.7° | 40.6° |
| C12 | C13 | C14 | H8 | 120.0° | 120.1° |
| C12 | C13 | C14 | H9 | 120.0° | 120.1° |
| C12 | C13 | C14 | N15 | 54.6° | 26.7° |
| C12 | C13 | C14 | C40 | 172.5° | 87.0° |
| C13 | C12 | C10 | H3 | 61.4° | 161.0° |
| C13 | C12 | H6 | H7 | 119.3° | 118.6° |
| C12 | C13 | H8 | H9 | 120.1° | 119.9° |
| C12 | C13 | C14 | H10 | 64.4° | 148.2° |
| N08 | C07 | C10 | C16 | 87.3° | 60.0° |
| N08 | C07 | C10 | H3 | 154.5° | 179.3° |
| C07 | C10 | C16 | H3 | 118.6° | 119.3° |
| C07 | C10 | C16 | N15 | 174.7° | 138.5° |
| C07 | C10 | C12 | H6 | 57.1° | 41.0° |
| C07 | C10 | C12 | H7 | 62.5° | 159.5° |
| C07 | C10 | C16 | H11 | 65.1° | 102.1° |
| C07 | C10 | C16 | H12 | 54.6° | 19.0° |
| C25 | C20 | C19 | C18 | 179.1° | 179.9° |
| C20 | C25 | N27 | C28 | 177.3° | 175.0° |
| C25 | C20 | C19 | H14 | 0.9° | 0.1° |
| C25 | C20 | C21 | H15 | 0.7° | 0.0° |
| C20 | C25 | N27 | H19 | 2.7° | 4.9° |
| N27 | C25 | C20 | C19 | 33.0° | 0.0° |
| C25 | N27 | C28 | C33 | 1.1° | 174.7° |
| C25 | N27 | C28 | H19 | 180.0° | 179.9° |
| C25 | N27 | C28 | N29 | 179.6° | 5.1° |
| C20 | C19 | C18 | H14 | 180.0° | 179.9° |
| C20 | C19 | C18 | H13 | 179.8° | 179.9° |
| C19 | C20 | C21 | H15 | 178.8° | 180.0° |
| C10 | C16 | N15 | H11 | 120.1° | 119.4° |
| C10 | C16 | N15 | H12 | 120.1° | 119.5° |
| C10 | C16 | N15 | C14 | 53.0° | 63.3° |
| C10 | C16 | N15 | C38 | 117.8° | 113.2° |
| C16 | C10 | C12 | H6 | 62.5° | 161.3° |
| C16 | C10 | C12 | H7 | 177.9° | 80.1° |
| C10 | C16 | H11 | H12 | 119.6° | 121.0° |
| C13 | C14 | N15 | C16 | 54.2° | 37.8° |
| C13 | C14 | N15 | C40 | 126.5° | 117.7° |
| C13 | C14 | N15 | H10 | 118.7° | 121.4° |
| C13 | C14 | C40 | H10 | 123.2° | 124.5° |
| C13 | C14 | N15 | C38 | 117.7° | 139.3° |
| C13 | C14 | C40 | C39 | 111.8° | 143.0° |
| C14 | C13 | C12 | H6 | 61.3° | 172.3° |
| C14 | C13 | C12 | H7 | 179.1° | 53.7° |
| C14 | C13 | H8 | H9 | 120.0° | 119.9° |
| C13 | C14 | C40 | H24 | 128.7° | 98.9° |
| C13 | C14 | C40 | H26 | 7.7° | 25.1° |
| C32 | C33 | C28 | H22 | 180.0° | 179.5° |
| C32 | C33 | C28 | N27 | 179.5° | 179.7° |
| C32 | C33 | C28 | N29 | 1.1° | 0.5° |
| C33 | C32 | C31 | C30 | 0.7° | 0.3° |
| C33 | C32 | C31 | H21 | 179.3° | 179.8° |
| C28 | C33 | C32 | C31 | 0.9° | 0.5° |
| C33 | C28 | N27 | N29 | 178.5° | 179.8° |
| C33 | C28 | N29 | C30 | 1.0° | 0.2° |
| C33 | C28 | N27 | H19 | 178.9° | 5.2° |
| C32 | C31 | C30 | H21 | 180.0° | 179.9° |
| C32 | C31 | C30 | N29 | 0.6° | 0.0° |
| C32 | C31 | C30 | H20 | 179.4° | 180.0° |
| C31 | C32 | C33 | H22 | 179.1° | 180.0° |
| N27 | C28 | N29 | C30 | 179.5° | 180.0° |
| N27 | C28 | C33 | H22 | 0.5° | 0.2° |
| C28 | N29 | C30 | C31 | 0.7° | 0.0° |
| N29 | C28 | N27 | H19 | 0.4° | 175.1° |
| C28 | N29 | C30 | H20 | 179.3° | 180.0° |
| N29 | C28 | C33 | H22 | 178.9° | 180.0° |
| C16 | N15 | C14 | C38 | 171.9° | 177.0° |
| C16 | N15 | C14 | C40 | 179.3° | 155.5° |
| C16 | N15 | C38 | C39 | 175.1° | 172.1° |
| C16 | N15 | C38 | O41 | 7.9° | 7.8° |
| N15 | C16 | C10 | H3 | 66.7° | 102.2° |
| C16 | N15 | C14 | H10 | 64.4° | 83.6° |
| N15 | C16 | H11 | H12 | 119.7° | 121.1° |
| N15 | C14 | C40 | H10 | 115.5° | 120.5° |
| N15 | C14 | C40 | C39 | 9.5° | 28.1° |
| C14 | N15 | C38 | C39 | 4.1° | 4.7° |
| C14 | N15 | C38 | O41 | 179.0° | 175.4° |
| N15 | C14 | C13 | H8 | 174.6° | 93.4° |
| N15 | C14 | C13 | H9 | 65.4° | 146.7° |
| C14 | N15 | C16 | H11 | 173.1° | 177.3° |
| C14 | N15 | C16 | H12 | 67.1° | 56.2° |
| N15 | C14 | C40 | H24 | 109.9° | 146.1° |
| N15 | C14 | C40 | H26 | 129.1° | 89.9° |
| C40 | C14 | N15 | C38 | 8.8° | 21.6° |
| C14 | C40 | C39 | H24 | 119.5° | 118.0° |
| C14 | C40 | C39 | H26 | 119.5° | 118.0° |
| C14 | C40 | C39 | C38 | 7.6° | 25.3° |
| C40 | C14 | C13 | H8 | 67.5° | 152.9° |
| C40 | C14 | C13 | H9 | 52.5° | 33.0° |
| C14 | C40 | C39 | H23 | 127.1° | 144.0° |
| C14 | C40 | H24 | H26 | 121.5° | 124.0° |
| C14 | C40 | C39 | H25 | 111.8° | 93.5° |
| C31 | C30 | N29 | H20 | 180.0° | 180.0° |
| N15 | C38 | C39 | C40 | 2.5° | 13.9° |
| N15 | C38 | C39 | O41 | 176.9° | 179.8° |
| C38 | N15 | C14 | H10 | 123.7° | 99.3° |
| C38 | N15 | C16 | H11 | 2.3° | 6.2° |
| C38 | N15 | C16 | H12 | 122.1° | 127.3° |
| N15 | C38 | C39 | H23 | 122.0° | 132.6° |
| N15 | C38 | C39 | H25 | 116.9° | 104.9° |
| C40 | C39 | C38 | H23 | 119.4° | 118.7° |
| C40 | C39 | C38 | H25 | 119.4° | 118.8° |
| C40 | C39 | C38 | O41 | 174.3° | 166.0° |
| C39 | C40 | C14 | H10 | 125.0° | 92.5° |
| C40 | C39 | H23 | H25 | 121.7° | 122.6° |
| C39 | C40 | H24 | H26 | 121.5° | 123.9° |
| C38 | C39 | H23 | H25 | 121.7° | 122.5° |
| C38 | C39 | C40 | H24 | 111.9° | 143.3° |
| C38 | C39 | C40 | H26 | 127.1° | 92.7° |
| O41 | C38 | C39 | H23 | 54.9° | 47.3° |
| O41 | C38 | C39 | H25 | 66.2° | 75.2° |
| N29 | C30 | C31 | H21 | 179.4° | 179.9° |
| H1 | C02 | C03 | H2 | 0.7° | 0.0° |
| H3 | C10 | C12 | H6 | 178.4° | 78.3° |
| H3 | C10 | C12 | H7 | 58.8° | 40.2° |
| H3 | C10 | C16 | H11 | 53.4° | 17.2° |
| H3 | C10 | C16 | H12 | 173.2° | 138.3° |
| H6 | C12 | C13 | H8 | 58.7° | 67.7° |
| H6 | C12 | C13 | H9 | 178.8° | 52.2° |
| H7 | C12 | C13 | H8 | 60.9° | 173.7° |
| H7 | C12 | C13 | H9 | 59.2° | 66.4° |
| H8 | C13 | C14 | H10 | 55.5° | 28.1° |
| H9 | C13 | C14 | H10 | 175.6° | 91.8° |
| H10 | C14 | C40 | H24 | 5.6° | 25.6° |
| H10 | C14 | C40 | H26 | 115.5° | 149.6° |
| H13 | C18 | C19 | H14 | 0.2° | 0.0° |
| H16 | C24 | H17 | H18 | 120.0° | 119.9° |
| H20 | C30 | C31 | H21 | 0.6° | 0.0° |
| H23 | C39 | C40 | H24 | 7.6° | 97.9° |
| H23 | C39 | C40 | H26 | 113.5° | 26.0° |
| H24 | C40 | C39 | H25 | 128.7° | 24.6° |
| H25 | C39 | C40 | H26 | 7.7° | 148.5° |
