IHM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O17 | N37 | sing | 1.42Å | 1.23Å | |
| N37 | C36 | doub | 1.32Å | 1.43Å | Aromatic |
| N37 | C38 | sing | 1.32Å | 1.44Å | Aromatic |
| C36 | C35 | sing | 1.38Å | 1.42Å | Aromatic |
| C38 | C39 | doub | 1.38Å | 1.42Å | Aromatic |
| C35 | C34 | doub | 1.39Å | 1.46Å | Aromatic |
| C27 | C28 | doub | 1.38Å | 1.45Å | Aromatic |
| C27 | C26 | sing | 1.38Å | 1.45Å | Aromatic |
| C39 | C34 | sing | 1.39Å | 1.44Å | Aromatic |
| C28 | C23 | sing | 1.39Å | 1.46Å | Aromatic |
| C26 | C25 | doub | 1.39Å | 1.47Å | Aromatic |
| C34 | C32 | sing | 1.51Å | 1.50Å | |
| C19 | C20 | sing | 1.41Å | 1.46Å | Aromatic |
| C19 | C18 | doub | 1.35Å | 1.41Å | Aromatic |
| O31 | C30 | doub | 1.21Å | 1.26Å | |
| C23 | C20 | sing | 1.48Å | 1.47Å | |
| C23 | C24 | doub | 1.39Å | 1.44Å | Aromatic |
| C20 | N21 | doub | 1.32Å | 1.36Å | Aromatic |
| C25 | C24 | sing | 1.39Å | 1.46Å | Aromatic |
| C25 | N29 | sing | 1.40Å | 1.42Å | |
| C18 | N22 | sing | 1.35Å | 1.41Å | Aromatic |
| C30 | N29 | sing | 1.35Å | 1.41Å | |
| C30 | C33 | sing | 1.51Å | 1.51Å | |
| N21 | N22 | sing | 1.40Å | 1.34Å | Aromatic |
| N22 | C16 | sing | 1.47Å | 1.48Å | |
| C32 | C16 | sing | 1.53Å | 1.59Å | |
| C16 | C04 | sing | 1.51Å | 1.51Å | |
| C04 | C05 | doub | 1.38Å | 1.43Å | Aromatic |
| C04 | C03 | sing | 1.38Å | 1.44Å | Aromatic |
| C05 | C06 | sing | 1.39Å | 1.43Å | Aromatic |
| C03 | C02 | doub | 1.38Å | 1.42Å | Aromatic |
| C06 | O11 | sing | 1.36Å | 1.38Å | |
| C06 | C01 | doub | 1.39Å | 1.45Å | Aromatic |
| C12 | O11 | sing | 1.43Å | 1.45Å | |
| C12 | C13 | sing | 1.53Å | 1.49Å | |
| C02 | C01 | sing | 1.39Å | 1.48Å | Aromatic |
| C01 | O07 | sing | 1.36Å | 1.42Å | |
| C15 | C13 | sing | 1.53Å | 1.45Å | |
| C15 | C14 | sing | 1.53Å | 1.52Å | |
| C13 | C14 | sing | 1.53Å | 1.51Å | |
| O07 | C08 | sing | 1.43Å | 1.42Å | |
| F10 | C08 | sing | 1.40Å | 1.38Å | |
| C08 | F09 | sing | 1.40Å | 1.37Å | |
| C02 | H1 | sing | 1.08Å | 1.08Å | |
| C03 | H2 | sing | 1.08Å | 1.08Å | |
| C05 | H3 | sing | 1.08Å | 1.08Å | |
| C08 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | 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 | |
| C18 | H14 | sing | 1.08Å | 1.08Å | |
| C19 | H15 | sing | 1.08Å | 1.08Å | |
| C24 | H16 | sing | 1.08Å | 1.08Å | |
| C26 | H17 | sing | 1.08Å | 1.08Å | |
| C27 | H18 | sing | 1.08Å | 1.08Å | |
| C28 | H19 | sing | 1.08Å | 1.08Å | |
| N29 | H20 | sing | 0.97Å | 1.00Å | |
| C32 | H21 | sing | 1.09Å | 1.10Å | |
| C32 | H22 | sing | 1.09Å | 1.10Å | |
| C33 | H23 | sing | 1.09Å | 1.10Å | |
| C33 | H24 | sing | 1.09Å | 1.10Å | |
| C33 | H25 | sing | 1.09Å | 1.10Å | |
| C35 | H26 | sing | 1.08Å | 1.08Å | |
| C36 | H27 | sing | 1.08Å | 1.08Å | |
| C38 | H28 | sing | 1.08Å | 1.08Å | |
| C39 | H29 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O17 | N37 | C36 | 120.4° | 119.2° |
| O17 | N37 | C38 | 120.5° | 119.1° |
| C36 | N37 | C38 | 119.1° | 121.7° |
| N37 | C36 | C35 | 121.0° | 120.7° |
| N37 | C36 | H27 | 119.5° | 119.6° |
| N37 | C38 | C39 | 120.9° | 120.7° |
| N37 | C38 | H28 | 119.5° | 119.6° |
| C36 | C35 | C34 | 119.7° | 119.2° |
| C36 | C35 | H26 | 120.2° | 120.4° |
| C35 | C36 | H27 | 119.5° | 119.6° |
| C38 | C39 | C34 | 119.9° | 119.2° |
| C39 | C38 | H28 | 119.6° | 119.6° |
| C38 | C39 | H29 | 120.1° | 120.4° |
| C35 | C34 | C39 | 119.3° | 118.4° |
| C35 | C34 | C32 | 120.9° | 120.8° |
| C34 | C35 | H26 | 120.1° | 120.4° |
| C28 | C27 | C26 | 120.8° | 120.2° |
| C27 | C28 | C23 | 119.5° | 120.0° |
| C28 | C27 | H18 | 119.6° | 119.9° |
| C27 | C28 | H19 | 120.2° | 119.9° |
| C27 | C26 | C25 | 119.9° | 120.2° |
| C27 | C26 | H17 | 120.1° | 119.9° |
| C26 | C27 | H18 | 119.6° | 120.0° |
| C39 | C34 | C32 | 119.8° | 120.8° |
| C34 | C39 | H29 | 120.1° | 120.4° |
| C28 | C23 | C20 | 122.4° | 120.1° |
| C28 | C23 | C24 | 119.8° | 119.9° |
| C23 | C28 | H19 | 120.3° | 120.0° |
| C26 | C25 | C24 | 118.8° | 120.0° |
| C26 | C25 | N29 | 123.4° | 120.0° |
| C25 | C26 | H17 | 120.1° | 119.9° |
| C34 | C32 | C16 | 107.5° | 109.5° |
| C34 | C32 | H21 | 110.0° | 109.5° |
| C34 | C32 | H22 | 110.0° | 109.5° |
| C20 | C19 | C18 | 104.9° | 107.9° |
| C19 | C20 | C23 | 128.1° | 126.0° |
| C19 | C20 | N21 | 109.3° | 107.9° |
| C20 | C19 | H15 | 127.5° | 126.1° |
| C19 | C18 | N22 | 106.5° | 108.0° |
| C19 | C18 | H14 | 126.8° | 126.1° |
| C18 | C19 | H15 | 127.6° | 126.0° |
| O31 | C30 | N29 | 124.2° | 120.0° |
| O31 | C30 | C33 | 120.8° | 120.0° |
| C20 | C23 | C24 | 117.8° | 120.1° |
| C23 | C20 | N21 | 122.7° | 126.0° |
| C23 | C24 | C25 | 121.3° | 119.8° |
| C23 | C24 | H16 | 119.3° | 120.1° |
| C20 | N21 | N22 | 107.9° | 108.1° |
| C24 | C25 | N29 | 117.9° | 120.0° |
| C25 | C24 | H16 | 119.4° | 120.1° |
| C25 | N29 | C30 | 129.4° | 120.0° |
| C25 | N29 | H20 | 115.3° | 120.0° |
| C18 | N22 | N21 | 111.4° | 108.1° |
| C18 | N22 | C16 | 125.9° | 126.0° |
| N22 | C18 | H14 | 126.7° | 126.0° |
| N29 | C30 | C33 | 115.1° | 120.0° |
| C30 | N29 | H20 | 115.3° | 119.9° |
| C30 | C33 | H23 | 109.5° | 109.5° |
| C30 | C33 | H24 | 109.5° | 109.4° |
| C30 | C33 | H25 | 109.5° | 109.5° |
| N21 | N22 | C16 | 122.7° | 125.9° |
| N22 | C16 | C32 | 111.5° | 109.5° |
| N22 | C16 | C04 | 112.8° | 109.5° |
| N22 | C16 | H12 | 107.3° | 109.4° |
| C32 | C16 | C04 | 111.7° | 109.5° |
| C32 | C16 | H12 | 106.1° | 109.5° |
| C16 | C32 | H21 | 110.0° | 109.5° |
| C16 | C32 | H22 | 110.0° | 109.5° |
| C16 | C04 | C05 | 119.6° | 119.9° |
| C16 | C04 | C03 | 120.2° | 119.9° |
| C04 | C16 | H12 | 107.0° | 109.5° |
| C05 | C04 | C03 | 120.1° | 120.2° |
| C04 | C05 | C06 | 121.8° | 120.0° |
| C04 | C05 | H3 | 119.1° | 120.0° |
| C04 | C03 | C02 | 119.5° | 120.2° |
| C04 | C03 | H2 | 120.2° | 119.9° |
| C05 | C06 | O11 | 125.6° | 120.0° |
| C05 | C06 | C01 | 119.2° | 119.9° |
| C06 | C05 | H3 | 119.1° | 120.0° |
| C03 | C02 | C01 | 120.7° | 120.0° |
| C03 | C02 | H1 | 119.7° | 120.0° |
| C02 | C03 | H2 | 120.3° | 119.9° |
| O11 | C06 | C01 | 115.2° | 120.1° |
| C06 | O11 | C12 | 116.8° | 117.0° |
| C06 | C01 | C02 | 118.7° | 119.8° |
| C06 | C01 | O07 | 116.2° | 120.1° |
| O11 | C12 | C13 | 106.5° | 109.5° |
| O11 | C12 | H5 | 110.2° | 109.5° |
| O11 | C12 | H6 | 110.2° | 109.5° |
| C12 | C13 | C15 | 135.8° | 117.5° |
| C12 | C13 | C14 | 111.7° | 117.5° |
| C13 | C12 | H5 | 110.2° | 109.5° |
| C13 | C12 | H6 | 110.2° | 109.4° |
| C12 | C13 | H7 | 111.1° | 115.5° |
| C02 | C01 | O07 | 125.1° | 120.1° |
| C01 | C02 | H1 | 119.7° | 119.9° |
| C01 | O07 | C08 | 125.2° | 117.0° |
| C13 | C15 | C14 | 61.0° | 60.0° |
| C15 | C13 | C14 | 61.8° | 60.0° |
| C15 | C13 | H7 | 111.6° | 117.5° |
| C13 | C15 | H10 | 119.8° | 117.5° |
| C13 | C15 | H11 | 119.8° | 117.5° |
| C15 | C14 | C13 | 57.1° | 60.0° |
| C15 | C14 | H8 | 120.4° | 117.5° |
| C15 | C14 | H9 | 120.5° | 117.5° |
| C14 | C15 | H10 | 119.8° | 117.5° |
| C14 | C15 | H11 | 119.8° | 117.5° |
| C14 | C13 | H7 | 110.7° | 117.5° |
| C13 | C14 | H8 | 120.4° | 117.5° |
| C13 | C14 | H9 | 120.5° | 117.5° |
| O07 | C08 | F10 | 108.9° | 109.5° |
| O07 | C08 | F09 | 113.8° | 109.5° |
| O07 | C08 | H4 | 108.0° | 109.5° |
| F10 | C08 | F09 | 108.6° | 109.5° |
| F10 | C08 | H4 | 108.6° | 109.5° |
| F09 | C08 | H4 | 108.8° | 109.4° |
| H5 | C12 | H6 | 109.4° | 109.5° |
| H8 | C14 | H9 | 109.5° | 115.5° |
| H10 | C15 | H11 | 109.5° | 115.6° |
| H21 | C32 | H22 | 109.5° | 109.4° |
| H23 | C33 | H24 | 109.5° | 109.5° |
| H23 | C33 | H25 | 109.4° | 109.4° |
| H24 | C33 | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O17 | N37 | C36 | C38 | 179.8° | 180.0° |
| O17 | N37 | C36 | C35 | 179.5° | 180.0° |
| O17 | N37 | C38 | C39 | 179.6° | 179.7° |
| O17 | N37 | C36 | H27 | 0.4° | 0.1° |
| O17 | N37 | C38 | H28 | 0.4° | 0.0° |
| N37 | C36 | C35 | H27 | 180.0° | 179.9° |
| C36 | N37 | C38 | C39 | 0.1° | 0.3° |
| N37 | C36 | C35 | C34 | 0.1° | 0.0° |
| N37 | C36 | C35 | H26 | 179.9° | 180.0° |
| C36 | N37 | C38 | H28 | 179.8° | 180.0° |
| C38 | N37 | C36 | C35 | 0.2° | 0.0° |
| N37 | C38 | C39 | H28 | 180.0° | 179.7° |
| N37 | C38 | C39 | C34 | 0.1° | 0.6° |
| C38 | N37 | C36 | H27 | 179.8° | 179.9° |
| N37 | C38 | C39 | H29 | 179.9° | 180.0° |
| C36 | C35 | C34 | H26 | 180.0° | 180.0° |
| C36 | C35 | C34 | C39 | 0.1° | 0.3° |
| C36 | C35 | C34 | C32 | 179.2° | 180.0° |
| C38 | C39 | C34 | C35 | 0.2° | 0.6° |
| C38 | C39 | C34 | H29 | 180.0° | 179.4° |
| C38 | C39 | C34 | C32 | 179.1° | 179.7° |
| C35 | C34 | C39 | C32 | 179.4° | 179.7° |
| C35 | C34 | C32 | C16 | 64.6° | 90.0° |
| C35 | C34 | C32 | H21 | 55.0° | 30.0° |
| C35 | C34 | C32 | H22 | 175.7° | 150.0° |
| C34 | C35 | C36 | H27 | 180.0° | 180.0° |
| C35 | C34 | C39 | H29 | 179.8° | 179.9° |
| C28 | C27 | C26 | H18 | 180.0° | 179.5° |
| C27 | C28 | C23 | H19 | 180.0° | 179.5° |
| C28 | C27 | C26 | C25 | 0.2° | 0.3° |
| C27 | C28 | C23 | C20 | 179.5° | 179.7° |
| C27 | C28 | C23 | C24 | 0.1° | 0.4° |
| C28 | C27 | C26 | H17 | 179.8° | 179.8° |
| C26 | C27 | C28 | C23 | 0.2° | 0.5° |
| C27 | C26 | C25 | H17 | 180.0° | 179.9° |
| C27 | C26 | C25 | C24 | 0.1° | 0.0° |
| C27 | C26 | C25 | N29 | 179.8° | 179.9° |
| C26 | C27 | C28 | H19 | 179.8° | 179.9° |
| C39 | C34 | C32 | C16 | 114.7° | 90.3° |
| C39 | C34 | C32 | H21 | 125.6° | 149.7° |
| C39 | C34 | C32 | H22 | 5.0° | 29.8° |
| C39 | C34 | C35 | H26 | 179.8° | 179.7° |
| C34 | C39 | C38 | H28 | 179.9° | 179.7° |
| C28 | C23 | C20 | C19 | 0.0° | 0.2° |
| C28 | C23 | C20 | C24 | 179.4° | 179.8° |
| C28 | C23 | C20 | N21 | 179.6° | 179.7° |
| C28 | C23 | C24 | C25 | 0.1° | 0.2° |
| C28 | C23 | C24 | H16 | 179.9° | 179.8° |
| C23 | C28 | C27 | H18 | 179.8° | 180.0° |
| C26 | C25 | C24 | C23 | 0.1° | 0.1° |
| C26 | C25 | C24 | N29 | 179.7° | 179.9° |
| C26 | C25 | N29 | C30 | 129.6° | 144.7° |
| C26 | C25 | C24 | H16 | 179.9° | 180.0° |
| C25 | C26 | C27 | H18 | 179.8° | 179.8° |
| C26 | C25 | N29 | H20 | 50.4° | 35.2° |
| C34 | C32 | C16 | N22 | 53.0° | 175.0° |
| C34 | C32 | C16 | H21 | 119.7° | 120.0° |
| C34 | C32 | C16 | H22 | 119.7° | 120.0° |
| C34 | C32 | C16 | C04 | 179.7° | 65.0° |
| C34 | C32 | C16 | H12 | 63.5° | 55.0° |
| C34 | C32 | H21 | H22 | 120.9° | 120.0° |
| C32 | C34 | C35 | H26 | 0.8° | 0.0° |
| C32 | C34 | C39 | H29 | 0.9° | 0.3° |
| C20 | C19 | C18 | H15 | 180.0° | 179.9° |
| C19 | C20 | C23 | N21 | 179.6° | 180.0° |
| C19 | C20 | C23 | C24 | 179.5° | 179.9° |
| C20 | C19 | C18 | N22 | 0.1° | 0.0° |
| C19 | C20 | N21 | N22 | 0.2° | 0.0° |
| C20 | C19 | C18 | H14 | 179.9° | 179.8° |
| C18 | C19 | C20 | C23 | 179.5° | 180.0° |
| C18 | C19 | C20 | N21 | 0.2° | 0.0° |
| C19 | C18 | N22 | H14 | 180.0° | 179.8° |
| C19 | C18 | N22 | N21 | 0.0° | 0.0° |
| C19 | C18 | N22 | C16 | 180.0° | 179.7° |
| O31 | C30 | N29 | C25 | 0.2° | 4.7° |
| O31 | C30 | N29 | C33 | 179.8° | 180.0° |
| O31 | C30 | N29 | H20 | 179.8° | 175.3° |
| O31 | C30 | C33 | H23 | 0.0° | 90.1° |
| O31 | C30 | C33 | H24 | 120.0° | 30.0° |
| O31 | C30 | C33 | H25 | 120.0° | 150.0° |
| C20 | C23 | C24 | C25 | 179.4° | 180.0° |
| C23 | C20 | N21 | N22 | 179.5° | 180.0° |
| C23 | C20 | C19 | H15 | 0.5° | 0.0° |
| C20 | C23 | C24 | H16 | 0.6° | 0.0° |
| C20 | C23 | C28 | H19 | 0.5° | 0.2° |
| C24 | C23 | C20 | N21 | 0.2° | 0.1° |
| C23 | C24 | C25 | H16 | 180.0° | 179.9° |
| C23 | C24 | C25 | N29 | 179.7° | 180.0° |
| C24 | C23 | C28 | H19 | 180.0° | 180.0° |
| C20 | N21 | N22 | C18 | 0.1° | 0.0° |
| C20 | N21 | N22 | C16 | 179.9° | 179.7° |
| N21 | C20 | C19 | H15 | 179.8° | 179.9° |
| C24 | C25 | N29 | C30 | 50.1° | 35.3° |
| C24 | C25 | C26 | H17 | 179.9° | 179.9° |
| C24 | C25 | N29 | H20 | 129.9° | 144.7° |
| C25 | N29 | C30 | H20 | 180.0° | 179.9° |
| C25 | N29 | C30 | C33 | 180.0° | 175.2° |
| N29 | C25 | C24 | H16 | 0.3° | 0.1° |
| N29 | C25 | C26 | H17 | 0.2° | 0.0° |
| C18 | N22 | N21 | C16 | 180.0° | 179.7° |
| C18 | N22 | C16 | C32 | 138.6° | 84.6° |
| C18 | N22 | C16 | C04 | 94.8° | 35.4° |
| C18 | N22 | C16 | H12 | 22.8° | 155.4° |
| N22 | C18 | C19 | H15 | 179.9° | 179.9° |
| N29 | C30 | C33 | H23 | 179.8° | 90.0° |
| N29 | C30 | C33 | H24 | 60.2° | 150.0° |
| N29 | C30 | C33 | H25 | 59.8° | 30.0° |
| C33 | C30 | N29 | H20 | 0.0° | 4.7° |
| C30 | C33 | H23 | H24 | 120.0° | 120.0° |
| C30 | C33 | H23 | H25 | 120.0° | 120.0° |
| C30 | C33 | H24 | H25 | 120.0° | 120.0° |
| N21 | N22 | C16 | C32 | 41.4° | 95.0° |
| N21 | N22 | C16 | C04 | 85.2° | 145.0° |
| N21 | N22 | C16 | H12 | 157.2° | 24.9° |
| N21 | N22 | C18 | H14 | 180.0° | 179.8° |
| N22 | C16 | C32 | C04 | 127.3° | 120.0° |
| N22 | C16 | C32 | H12 | 116.5° | 120.0° |
| N22 | C16 | C04 | H12 | 117.8° | 120.0° |
| N22 | C16 | C04 | C05 | 19.7° | 112.3° |
| N22 | C16 | C04 | C03 | 159.4° | 67.4° |
| C16 | N22 | C18 | H14 | 0.0° | 0.1° |
| N22 | C16 | C32 | H21 | 172.8° | 55.0° |
| N22 | C16 | C32 | H22 | 66.7° | 65.0° |
| C32 | C16 | C04 | H12 | 115.7° | 120.0° |
| C32 | C16 | C04 | C05 | 106.9° | 127.7° |
| C32 | C16 | C04 | C03 | 74.0° | 52.6° |
| C16 | C32 | H21 | H22 | 120.9° | 120.0° |
| C16 | C04 | C05 | C03 | 179.1° | 179.7° |
| C16 | C04 | C05 | C06 | 178.9° | 180.0° |
| C16 | C04 | C03 | C02 | 179.0° | 179.7° |
| C16 | C04 | C03 | H2 | 1.0° | 0.3° |
| C16 | C04 | C05 | H3 | 1.1° | 0.3° |
| C04 | C16 | C32 | H21 | 60.0° | 175.0° |
| C04 | C16 | C32 | H22 | 60.6° | 55.0° |
| C04 | C05 | C06 | H3 | 180.0° | 179.7° |
| C05 | C04 | C03 | C02 | 0.1° | 0.0° |
| C04 | C05 | C06 | O11 | 179.5° | 180.0° |
| C04 | C05 | C06 | C01 | 0.1° | 0.6° |
| C05 | C04 | C03 | H2 | 179.9° | 180.0° |
| C05 | C04 | C16 | H12 | 137.4° | 7.7° |
| C03 | C04 | C05 | C06 | 0.2° | 0.3° |
| C04 | C03 | C02 | H2 | 180.0° | 180.0° |
| C04 | C03 | C02 | C01 | 0.2° | 0.0° |
| C04 | C03 | C02 | H1 | 179.8° | 180.0° |
| C03 | C04 | C05 | H3 | 179.8° | 180.0° |
| C03 | C04 | C16 | H12 | 41.6° | 172.6° |
| C05 | C06 | O11 | C01 | 179.5° | 179.4° |
| C05 | C06 | O11 | C12 | 27.6° | 0.0° |
| C05 | C06 | C01 | C02 | 0.4° | 0.6° |
| C05 | C06 | C01 | O07 | 179.2° | 179.7° |
| C03 | C02 | C01 | C06 | 0.4° | 0.3° |
| C03 | C02 | C01 | H1 | 180.0° | 179.9° |
| C03 | C02 | C01 | O07 | 179.1° | 180.0° |
| C06 | O11 | C12 | C13 | 179.7° | 180.0° |
| O11 | C06 | C01 | C02 | 179.9° | 180.0° |
| O11 | C06 | C01 | O07 | 0.3° | 0.3° |
| O11 | C06 | C05 | H3 | 0.5° | 0.3° |
| C06 | O11 | C12 | H5 | 60.2° | 60.0° |
| C06 | O11 | C12 | H6 | 60.7° | 60.0° |
| C01 | C06 | O11 | C12 | 151.9° | 179.4° |
| C06 | C01 | C02 | O07 | 179.5° | 179.7° |
| C06 | C01 | O07 | C08 | 178.9° | 179.7° |
| C06 | C01 | C02 | H1 | 179.5° | 179.8° |
| C01 | C06 | C05 | H3 | 179.9° | 179.7° |
| O11 | C12 | C13 | H5 | 119.6° | 120.0° |
| O11 | C12 | C13 | H6 | 119.6° | 120.0° |
| O11 | C12 | C13 | C15 | 143.8° | 116.3° |
| O11 | C12 | C13 | C14 | 72.3° | 175.0° |
| O11 | C12 | H5 | H6 | 121.4° | 120.0° |
| O11 | C12 | C13 | H7 | 51.8° | 29.4° |
| C12 | C13 | C15 | C14 | 93.0° | 107.5° |
| C12 | C13 | C15 | H7 | 164.4° | 145.0° |
| C12 | C13 | C14 | H7 | 124.3° | 145.0° |
| C13 | C12 | H5 | H6 | 121.3° | 119.9° |
| C12 | C13 | C14 | H8 | 22.8° | 145.0° |
| C12 | C13 | C14 | H9 | 119.9° | 0.0° |
| C12 | C13 | C15 | H10 | 16.8° | 0.1° |
| C12 | C13 | C15 | H11 | 157.3° | 145.0° |
| C02 | C01 | O07 | C08 | 0.7° | 0.0° |
| C01 | C02 | C03 | H2 | 179.8° | 180.0° |
| C01 | O07 | C08 | F10 | 59.3° | 60.0° |
| C01 | O07 | C08 | F09 | 62.0° | 60.0° |
| O07 | C01 | C02 | H1 | 0.9° | 0.0° |
| C01 | O07 | C08 | H4 | 177.0° | 179.9° |
| C13 | C15 | C14 | H10 | 109.7° | 107.5° |
| C13 | C15 | C14 | H11 | 109.8° | 107.6° |
| C15 | C13 | C14 | H7 | 104.2° | 107.5° |
| C15 | C13 | C12 | H5 | 24.2° | 123.6° |
| C15 | C13 | C12 | H6 | 96.7° | 3.7° |
| C13 | C15 | C14 | H8 | 108.6° | 107.5° |
| C13 | C15 | C14 | H9 | 108.7° | 107.4° |
| C13 | C15 | H10 | H11 | 144.2° | 145.8° |
| C15 | C14 | H8 | H9 | 146.3° | 145.8° |
| C14 | C15 | H10 | H11 | 144.2° | 145.6° |
| C14 | C13 | C12 | H5 | 47.2° | 55.0° |
| C14 | C13 | C12 | H6 | 168.1° | 65.0° |
| C13 | C14 | H8 | H9 | 146.3° | 145.6° |
| O07 | C08 | F10 | F09 | 124.4° | 120.0° |
| O07 | C08 | F10 | H4 | 117.4° | 120.0° |
| O07 | C08 | F09 | H4 | 120.5° | 120.0° |
| F10 | C08 | F09 | H4 | 118.1° | 120.0° |
| H1 | C02 | C03 | H2 | 0.3° | 0.1° |
| H5 | C12 | C13 | H7 | 171.4° | 90.7° |
| H6 | C12 | C13 | H7 | 67.7° | 149.4° |
| H7 | C13 | C14 | H8 | 147.2° | 0.0° |
| H7 | C13 | C14 | H9 | 4.5° | 144.9° |
| H7 | C13 | C15 | H10 | 147.6° | 145.1° |
| H7 | C13 | C15 | H11 | 7.1° | 0.0° |
| H8 | C14 | C15 | H10 | 1.1° | 145.0° |
| H8 | C14 | C15 | H11 | 141.6° | 0.0° |
| H9 | C14 | C15 | H10 | 141.6° | 0.0° |
| H9 | C14 | C15 | H11 | 1.1° | 145.0° |
| H12 | C16 | C32 | H21 | 56.2° | 65.0° |
| H12 | C16 | C32 | H22 | 176.8° | 175.1° |
| H14 | C18 | C19 | H15 | 0.1° | 0.3° |
| H17 | C26 | C27 | H18 | 0.2° | 0.3° |
| H18 | C27 | C28 | H19 | 0.2° | 0.4° |
| H23 | C33 | H24 | H25 | 120.0° | 120.0° |
| H26 | C35 | C36 | H27 | 0.0° | 0.1° |
| H28 | C38 | C39 | H29 | 0.1° | 0.3° |
