A1KBG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | C31 | sing | 1.53Å | 1.53Å | |
| C30 | C29 | sing | 1.53Å | 1.46Å | |
| C31 | O32 | sing | 1.43Å | 1.48Å | |
| C33 | O32 | sing | 1.43Å | 1.47Å | |
| C33 | C34 | sing | 1.53Å | 1.53Å | |
| C34 | C29 | sing | 1.53Å | 1.49Å | |
| C28 | C29 | sing | 1.53Å | 1.53Å | |
| C28 | N21 | sing | 1.47Å | 1.45Å | |
| C29 | C35 | sing | 1.47Å | 1.60Å | |
| C27 | O26 | sing | 1.43Å | 1.40Å | |
| O26 | C25 | sing | 1.43Å | 1.40Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| N21 | C17 | sing | 1.39Å | 1.46Å | |
| N22 | C23 | sing | 1.46Å | 1.45Å | |
| N22 | C01 | sing | 1.40Å | 1.45Å | |
| C23 | C25 | sing | 1.53Å | 1.53Å | |
| C35 | N36 | trip | 1.14Å | 1.13Å | |
| C17 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
| C17 | N16 | sing | 1.32Å | 1.32Å | Aromatic |
| C06 | C01 | doub | 1.39Å | 1.39Å | Aromatic |
| C06 | C05 | sing | 1.38Å | 1.39Å | Aromatic |
| C01 | C02 | sing | 1.39Å | 1.38Å | Aromatic |
| C18 | C19 | sing | 1.39Å | 1.39Å | Aromatic |
| N16 | C15 | doub | 1.33Å | 1.32Å | Aromatic |
| C05 | C04 | doub | 1.39Å | 1.39Å | Aromatic |
| C02 | C03 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | C20 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | C12 | sing | 1.48Å | 1.54Å | |
| C19 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
| C04 | C03 | sing | 1.39Å | 1.38Å | Aromatic |
| C04 | N07 | sing | 1.40Å | 1.45Å | |
| C12 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.40Å | 1.40Å | Aromatic |
| C13 | C08 | sing | 1.39Å | 1.39Å | Aromatic |
| CL14 | C11 | sing | 1.74Å | 1.78Å | |
| C11 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C08 | N07 | sing | 1.39Å | 1.45Å | |
| C08 | N09 | doub | 1.32Å | 1.31Å | Aromatic |
| C10 | N09 | sing | 1.32Å | 1.31Å | Aromatic |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C13 | H2 | sing | 1.08Å | 1.08Å | |
| C02 | H3 | sing | 1.08Å | 1.08Å | |
| C03 | H4 | sing | 1.08Å | 1.08Å | |
| C05 | H5 | sing | 1.08Å | 1.08Å | |
| C06 | H6 | sing | 1.08Å | 1.08Å | |
| C18 | H7 | sing | 1.08Å | 1.08Å | |
| C19 | H8 | sing | 1.08Å | 1.08Å | |
| C20 | H9 | sing | 1.08Å | 1.08Å | |
| C23 | H10 | sing | 1.09Å | 1.10Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C25 | H15 | sing | 1.09Å | 1.10Å | |
| C27 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C28 | H19 | sing | 1.09Å | 1.10Å | |
| C28 | H20 | sing | 1.09Å | 1.10Å | |
| C30 | H21 | sing | 1.09Å | 1.10Å | |
| C30 | H22 | sing | 1.09Å | 1.10Å | |
| C31 | H23 | sing | 1.09Å | 1.10Å | |
| C31 | H24 | sing | 1.09Å | 1.10Å | |
| C33 | H25 | sing | 1.09Å | 1.10Å | |
| C33 | H26 | sing | 1.09Å | 1.10Å | |
| C34 | H27 | sing | 1.09Å | 1.10Å | |
| C34 | H28 | sing | 1.09Å | 1.10Å | |
| N07 | H29 | sing | 0.97Å | 1.00Å | |
| N21 | H30 | sing | 0.97Å | 1.00Å | |
| N22 | H31 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C31 | C30 | C29 | 111.5° | 109.1° |
| C30 | C31 | O32 | 113.7° | 109.4° |
| C31 | C30 | H21 | 109.0° | 109.5° |
| C31 | C30 | H22 | 109.0° | 109.5° |
| C30 | C31 | H23 | 108.4° | 109.5° |
| C30 | C31 | H24 | 108.4° | 109.4° |
| C30 | C29 | C34 | 110.9° | 109.1° |
| C30 | C29 | C28 | 108.4° | 109.5° |
| C30 | C29 | C35 | 108.8° | 109.6° |
| C29 | C30 | H21 | 109.0° | 109.5° |
| C29 | C30 | H22 | 108.9° | 109.5° |
| C31 | O32 | C33 | 115.6° | 114.1° |
| O32 | C31 | H23 | 108.4° | 109.5° |
| O32 | C31 | H24 | 108.4° | 109.5° |
| O32 | C33 | C34 | 115.4° | 109.4° |
| O32 | C33 | H25 | 107.9° | 109.5° |
| O32 | C33 | H26 | 108.0° | 109.5° |
| C33 | C34 | C29 | 113.3° | 109.1° |
| C34 | C33 | H25 | 108.0° | 109.5° |
| C34 | C33 | H26 | 107.9° | 109.5° |
| C33 | C34 | H27 | 108.5° | 109.5° |
| C33 | C34 | H28 | 108.5° | 109.6° |
| C34 | C29 | C28 | 109.4° | 109.5° |
| C34 | C29 | C35 | 109.6° | 109.6° |
| C29 | C34 | H27 | 108.5° | 109.5° |
| C29 | C34 | H28 | 108.5° | 109.6° |
| C29 | C28 | N21 | 110.9° | 109.5° |
| C28 | C29 | C35 | 109.7° | 109.5° |
| C29 | C28 | H19 | 109.1° | 109.5° |
| C29 | C28 | H20 | 109.1° | 109.5° |
| C28 | N21 | C17 | 119.6° | 120.0° |
| N21 | C28 | H19 | 109.1° | 109.5° |
| N21 | C28 | H20 | 109.1° | 109.4° |
| C28 | N21 | H30 | 106.9° | 120.0° |
| C29 | C35 | N36 | 179.7° | 179.9° |
| C27 | O26 | C25 | 113.8° | 114.0° |
| O26 | C27 | H16 | 109.5° | 109.5° |
| O26 | C27 | H17 | 109.4° | 109.4° |
| O26 | C27 | H18 | 109.5° | 109.5° |
| O26 | C25 | C23 | 108.5° | 109.5° |
| O26 | C25 | H14 | 109.7° | 109.5° |
| O26 | C25 | H15 | 109.7° | 109.5° |
| C24 | C23 | N22 | 109.0° | 109.5° |
| C24 | C23 | C25 | 109.8° | 109.4° |
| C24 | C23 | H10 | 109.2° | 109.4° |
| C23 | C24 | H11 | 109.5° | 109.5° |
| C23 | C24 | H12 | 109.5° | 109.5° |
| C23 | C24 | H13 | 109.5° | 109.5° |
| N21 | C17 | C18 | 119.9° | 119.6° |
| N21 | C17 | N16 | 119.9° | 119.7° |
| C17 | N21 | H30 | 106.9° | 120.0° |
| C23 | N22 | C01 | 119.3° | 120.0° |
| N22 | C23 | C25 | 109.4° | 109.5° |
| N22 | C23 | H10 | 110.3° | 109.5° |
| C23 | N22 | H31 | 107.0° | 120.0° |
| N22 | C01 | C06 | 120.3° | 120.0° |
| N22 | C01 | C02 | 119.5° | 120.0° |
| C01 | N22 | H31 | 107.0° | 120.0° |
| C25 | C23 | H10 | 109.2° | 109.5° |
| C23 | C25 | H14 | 109.7° | 109.5° |
| C23 | C25 | H15 | 109.7° | 109.4° |
| C18 | C17 | N16 | 120.2° | 120.7° |
| C17 | C18 | C19 | 118.6° | 119.3° |
| C17 | C18 | H7 | 120.7° | 120.4° |
| C17 | N16 | C15 | 123.3° | 121.5° |
| C01 | C06 | C05 | 120.2° | 120.0° |
| C06 | C01 | C02 | 120.2° | 120.0° |
| C01 | C06 | H6 | 119.9° | 120.0° |
| C06 | C05 | C04 | 119.6° | 120.0° |
| C06 | C05 | H5 | 120.2° | 120.1° |
| C05 | C06 | H6 | 119.9° | 120.0° |
| C01 | C02 | C03 | 119.5° | 120.0° |
| C01 | C02 | H3 | 120.2° | 120.0° |
| C18 | C19 | C20 | 119.1° | 118.6° |
| C19 | C18 | H7 | 120.7° | 120.3° |
| C18 | C19 | H8 | 120.4° | 120.7° |
| N16 | C15 | C20 | 119.4° | 120.7° |
| N16 | C15 | C12 | 119.1° | 119.6° |
| C05 | C04 | C03 | 120.0° | 120.0° |
| C05 | C04 | N07 | 120.9° | 120.0° |
| C04 | C05 | H5 | 120.2° | 120.0° |
| C02 | C03 | C04 | 120.5° | 120.0° |
| C03 | C02 | H3 | 120.3° | 120.0° |
| C02 | C03 | H4 | 119.8° | 120.0° |
| C20 | C15 | C12 | 121.5° | 119.7° |
| C15 | C20 | C19 | 119.3° | 119.3° |
| C15 | C20 | H9 | 120.3° | 120.4° |
| C15 | C12 | C13 | 119.3° | 120.8° |
| C15 | C12 | C11 | 123.4° | 120.9° |
| C20 | C19 | H8 | 120.5° | 120.8° |
| C19 | C20 | H9 | 120.4° | 120.3° |
| C03 | C04 | N07 | 119.0° | 120.0° |
| C04 | C03 | H4 | 119.7° | 120.0° |
| C04 | N07 | C08 | 124.0° | 120.0° |
| C04 | N07 | H29 | 118.0° | 120.0° |
| C13 | C12 | C11 | 117.3° | 118.3° |
| C12 | C13 | C08 | 119.1° | 118.9° |
| C12 | C13 | H2 | 120.5° | 120.6° |
| C12 | C11 | CL14 | 121.9° | 120.4° |
| C12 | C11 | C10 | 120.0° | 119.1° |
| C13 | C08 | N07 | 121.5° | 119.6° |
| C13 | C08 | N09 | 121.5° | 120.8° |
| C08 | C13 | H2 | 120.5° | 120.5° |
| CL14 | C11 | C10 | 118.1° | 120.5° |
| C11 | C10 | N09 | 120.6° | 121.0° |
| C11 | C10 | H1 | 119.7° | 119.4° |
| N07 | C08 | N09 | 117.0° | 119.6° |
| C08 | N07 | H29 | 118.0° | 120.0° |
| C08 | N09 | C10 | 121.5° | 121.9° |
| N09 | C10 | H1 | 119.7° | 119.5° |
| H11 | C24 | H12 | 109.5° | 109.5° |
| H11 | C24 | H13 | 109.5° | 109.4° |
| H12 | C24 | H13 | 109.4° | 109.4° |
| H14 | C25 | H15 | 109.5° | 109.5° |
| H16 | C27 | H17 | 109.5° | 109.5° |
| H16 | C27 | H18 | 109.5° | 109.5° |
| H17 | C27 | H18 | 109.4° | 109.4° |
| H19 | C28 | H20 | 109.5° | 109.5° |
| H21 | C30 | H22 | 109.5° | 109.6° |
| H23 | C31 | H24 | 109.5° | 109.5° |
| H25 | C33 | H26 | 109.5° | 109.5° |
| H27 | C34 | H28 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C31 | C30 | C29 | H21 | 120.3° | 119.9° |
| C31 | C30 | C29 | H22 | 120.3° | 119.9° |
| C30 | C31 | O32 | H23 | 120.6° | 120.0° |
| C30 | C31 | O32 | H24 | 120.6° | 119.9° |
| C30 | C31 | O32 | C33 | 21.4° | 61.2° |
| C31 | C30 | C29 | C34 | 64.7° | 57.0° |
| C31 | C30 | C29 | C28 | 175.2° | 176.8° |
| C31 | C30 | C29 | C35 | 55.9° | 63.0° |
| C31 | C30 | H21 | H22 | 119.1° | 120.2° |
| C30 | C31 | H23 | H24 | 118.1° | 120.0° |
| C29 | C30 | C31 | O32 | 32.7° | 57.6° |
| C30 | C29 | C34 | C33 | 40.1° | 56.9° |
| C30 | C29 | C34 | C28 | 119.6° | 119.9° |
| C30 | C29 | C34 | C35 | 120.2° | 119.9° |
| C30 | C29 | C28 | C35 | 118.7° | 120.2° |
| C30 | C29 | C28 | N21 | 174.2° | 179.8° |
| C30 | C29 | C35 | N36 | 26.3° | 106.6° |
| C30 | C29 | C28 | H19 | 54.0° | 59.8° |
| C30 | C29 | C28 | H20 | 65.6° | 60.2° |
| C29 | C30 | H21 | H22 | 119.0° | 120.2° |
| C29 | C30 | C31 | H23 | 87.9° | 62.4° |
| C29 | C30 | C31 | H24 | 153.4° | 177.6° |
| C30 | C29 | C34 | H27 | 160.7° | 62.9° |
| C30 | C29 | C34 | H28 | 80.5° | 176.9° |
| C31 | O32 | C33 | C34 | 45.6° | 61.2° |
| O32 | C31 | C30 | H21 | 87.5° | 177.5° |
| O32 | C31 | C30 | H22 | 153.0° | 62.3° |
| O32 | C31 | H23 | H24 | 118.1° | 120.0° |
| C31 | O32 | C33 | H25 | 166.5° | 178.8° |
| C31 | O32 | C33 | H26 | 75.3° | 58.8° |
| O32 | C33 | C34 | H25 | 120.9° | 120.0° |
| O32 | C33 | C34 | H26 | 120.9° | 120.0° |
| O32 | C33 | C34 | C29 | 13.8° | 57.5° |
| C33 | O32 | C31 | H23 | 142.0° | 58.8° |
| C33 | O32 | C31 | H24 | 99.2° | 178.8° |
| O32 | C33 | H25 | H26 | 117.3° | 120.0° |
| O32 | C33 | C34 | H27 | 106.7° | 62.3° |
| O32 | C33 | C34 | H28 | 134.4° | 177.5° |
| C33 | C34 | C29 | H27 | 120.6° | 119.8° |
| C33 | C34 | C29 | H28 | 120.6° | 120.0° |
| C33 | C34 | C29 | C28 | 159.7° | 176.8° |
| C33 | C34 | C29 | C35 | 80.0° | 63.0° |
| C34 | C33 | H25 | H26 | 117.3° | 120.1° |
| C33 | C34 | H27 | H28 | 118.3° | 120.2° |
| C34 | C29 | C28 | C35 | 120.2° | 120.2° |
| C34 | C29 | C28 | N21 | 53.1° | 60.2° |
| C34 | C29 | C35 | N36 | 147.8° | 13.0° |
| C34 | C29 | C28 | H19 | 67.1° | 59.8° |
| C34 | C29 | C28 | H20 | 173.3° | 179.9° |
| C34 | C29 | C30 | H21 | 55.6° | 176.8° |
| C34 | C29 | C30 | H22 | 174.9° | 62.9° |
| C29 | C34 | C33 | H25 | 134.7° | 177.5° |
| C29 | C34 | C33 | H26 | 107.0° | 62.5° |
| C29 | C34 | H27 | H28 | 118.2° | 120.2° |
| C29 | C28 | N21 | H19 | 120.2° | 120.0° |
| C29 | C28 | N21 | H20 | 120.2° | 120.0° |
| C29 | C28 | N21 | C17 | 103.9° | 180.0° |
| C28 | C29 | C35 | N36 | 92.2° | 133.2° |
| C29 | C28 | H19 | H20 | 119.3° | 120.0° |
| C28 | C29 | C30 | H21 | 64.5° | 63.3° |
| C28 | C29 | C30 | H22 | 54.9° | 56.9° |
| C28 | C29 | C34 | H27 | 79.7° | 57.0° |
| C28 | C29 | C34 | H28 | 39.1° | 63.2° |
| C29 | C28 | N21 | H30 | 17.5° | 0.0° |
| N21 | C28 | C29 | C35 | 67.1° | 60.0° |
| C28 | N21 | C17 | H30 | 121.4° | 180.0° |
| C28 | N21 | C17 | C18 | 162.0° | 0.0° |
| C28 | N21 | C17 | N16 | 17.7° | 179.7° |
| N21 | C28 | H19 | H20 | 119.4° | 120.0° |
| C35 | C29 | C28 | H19 | 172.7° | 180.0° |
| C35 | C29 | C28 | H20 | 53.1° | 60.0° |
| C35 | C29 | C30 | H21 | 176.2° | 56.9° |
| C35 | C29 | C30 | H22 | 64.4° | 177.1° |
| C35 | C29 | C34 | H27 | 40.5° | 177.2° |
| C35 | C29 | C34 | H28 | 159.4° | 57.0° |
| C27 | O26 | C25 | C23 | 148.8° | 179.9° |
| C27 | O26 | C25 | H14 | 91.4° | 60.1° |
| C27 | O26 | C25 | H15 | 28.9° | 60.0° |
| O26 | C27 | H16 | H17 | 120.0° | 120.0° |
| O26 | C27 | H16 | H18 | 120.0° | 120.1° |
| O26 | C27 | H17 | H18 | 120.0° | 120.0° |
| O26 | C25 | C23 | C24 | 39.2° | 55.0° |
| O26 | C25 | C23 | N22 | 80.4° | 65.0° |
| O26 | C25 | C23 | H14 | 119.8° | 120.0° |
| O26 | C25 | C23 | H15 | 119.9° | 120.0° |
| O26 | C25 | C23 | H10 | 158.9° | 175.0° |
| O26 | C25 | H14 | H15 | 120.5° | 120.1° |
| C25 | O26 | C27 | H16 | 180.0° | 180.0° |
| C25 | O26 | C27 | H17 | 60.0° | 60.0° |
| C25 | O26 | C27 | H18 | 60.0° | 59.9° |
| C24 | C23 | N22 | C25 | 120.1° | 120.0° |
| C24 | C23 | N22 | H10 | 119.9° | 120.0° |
| C24 | C23 | N22 | C01 | 173.4° | 85.0° |
| C24 | C23 | C25 | H10 | 119.7° | 119.9° |
| C23 | C24 | H11 | H12 | 120.0° | 120.1° |
| C23 | C24 | H11 | H13 | 120.0° | 120.0° |
| C23 | C24 | H12 | H13 | 120.0° | 120.0° |
| C24 | C23 | C25 | H14 | 159.1° | 65.0° |
| C24 | C23 | C25 | H15 | 80.6° | 175.0° |
| C24 | C23 | N22 | H31 | 52.0° | 95.0° |
| N21 | C17 | C18 | N16 | 179.7° | 179.7° |
| N21 | C17 | C18 | C19 | 179.9° | 180.0° |
| N21 | C17 | N16 | C15 | 179.8° | 179.7° |
| N21 | C17 | C18 | H7 | 0.1° | 0.3° |
| C17 | N21 | C28 | H19 | 135.9° | 60.0° |
| C17 | N21 | C28 | H20 | 16.3° | 60.0° |
| C23 | N22 | C01 | H31 | 121.4° | 180.0° |
| N22 | C23 | C25 | H10 | 120.7° | 120.1° |
| C23 | N22 | C01 | C06 | 113.6° | 0.2° |
| C23 | N22 | C01 | C02 | 66.1° | 180.0° |
| N22 | C23 | C24 | H11 | 180.0° | 60.0° |
| N22 | C23 | C24 | H12 | 60.0° | 180.0° |
| N22 | C23 | C24 | H13 | 60.0° | 60.0° |
| N22 | C23 | C25 | H14 | 39.5° | 175.0° |
| N22 | C23 | C25 | H15 | 159.8° | 55.0° |
| C01 | N22 | C23 | C25 | 66.5° | 155.0° |
| N22 | C01 | C06 | C02 | 179.7° | 179.8° |
| N22 | C01 | C06 | C05 | 179.9° | 179.7° |
| N22 | C01 | C02 | C03 | 179.9° | 179.7° |
| N22 | C01 | C02 | H3 | 0.1° | 0.2° |
| N22 | C01 | C06 | H6 | 0.0° | 0.2° |
| C01 | N22 | C23 | H10 | 53.5° | 35.0° |
| C25 | C23 | C24 | H11 | 60.2° | 180.0° |
| C25 | C23 | C24 | H12 | 59.8° | 60.0° |
| C25 | C23 | C24 | H13 | 179.8° | 60.0° |
| C23 | C25 | H14 | H15 | 120.4° | 119.9° |
| C25 | C23 | N22 | H31 | 172.1° | 25.0° |
| C17 | C18 | C19 | H7 | 180.0° | 179.8° |
| C18 | C17 | N16 | C15 | 0.1° | 0.0° |
| C17 | C18 | C19 | C20 | 0.2° | 0.5° |
| C17 | C18 | C19 | H8 | 179.8° | 180.0° |
| C18 | C17 | N21 | H30 | 76.6° | 180.0° |
| N16 | C17 | C18 | C19 | 0.2° | 0.3° |
| C17 | N16 | C15 | C20 | 0.3° | 0.0° |
| C17 | N16 | C15 | C12 | 179.4° | 179.8° |
| N16 | C17 | C18 | H7 | 179.8° | 180.0° |
| N16 | C17 | N21 | H30 | 103.7° | 0.3° |
| C01 | C06 | C05 | H6 | 180.0° | 179.9° |
| C01 | C06 | C05 | C04 | 0.1° | 0.1° |
| C06 | C01 | C02 | C03 | 0.2° | 0.1° |
| C06 | C01 | C02 | H3 | 179.8° | 180.0° |
| C01 | C06 | C05 | H5 | 179.9° | 180.0° |
| C06 | C01 | N22 | H31 | 125.0° | 179.8° |
| C05 | C06 | C01 | C02 | 0.2° | 0.1° |
| C06 | C05 | C04 | H5 | 180.0° | 179.9° |
| C06 | C05 | C04 | C03 | 0.5° | 0.1° |
| C06 | C05 | C04 | N07 | 179.6° | 179.9° |
| C01 | C02 | C03 | H3 | 180.0° | 180.0° |
| C01 | C02 | C03 | C04 | 0.2° | 0.0° |
| C01 | C02 | C03 | H4 | 179.8° | 180.0° |
| C02 | C01 | C06 | H6 | 179.7° | 180.0° |
| C02 | C01 | N22 | H31 | 55.3° | 0.0° |
| C18 | C19 | C20 | C15 | 0.7° | 0.5° |
| C18 | C19 | C20 | H8 | 180.0° | 179.5° |
| C18 | C19 | C20 | H9 | 179.3° | 179.5° |
| N16 | C15 | C20 | C12 | 179.0° | 179.8° |
| N16 | C15 | C20 | C19 | 0.7° | 0.2° |
| N16 | C15 | C12 | C13 | 49.6° | 130.7° |
| N16 | C15 | C12 | C11 | 130.2° | 49.3° |
| N16 | C15 | C20 | H9 | 179.3° | 179.8° |
| C05 | C04 | C03 | C02 | 0.6° | 0.0° |
| C05 | C04 | C03 | N07 | 179.1° | 180.0° |
| C05 | C04 | N07 | C08 | 60.8° | 145.8° |
| C05 | C04 | C03 | H4 | 179.4° | 180.0° |
| C04 | C05 | C06 | H6 | 179.9° | 180.0° |
| C05 | C04 | N07 | H29 | 119.2° | 34.2° |
| C02 | C03 | C04 | H4 | 180.0° | 179.9° |
| C02 | C03 | C04 | N07 | 179.7° | 180.0° |
| C15 | C20 | C19 | H9 | 180.0° | 180.0° |
| C20 | C15 | C12 | C13 | 129.4° | 49.0° |
| C20 | C15 | C12 | C11 | 50.8° | 131.0° |
| C15 | C20 | C19 | H8 | 179.3° | 180.0° |
| C12 | C15 | C20 | C19 | 179.7° | 180.0° |
| C15 | C12 | C13 | C11 | 179.8° | 180.0° |
| C15 | C12 | C13 | C08 | 179.7° | 180.0° |
| C15 | C12 | C11 | CL14 | 0.0° | 0.0° |
| C15 | C12 | C11 | C10 | 180.0° | 180.0° |
| C15 | C12 | C13 | H2 | 0.3° | 0.0° |
| C12 | C15 | C20 | H9 | 0.3° | 0.0° |
| C20 | C19 | C18 | H7 | 179.8° | 179.7° |
| C03 | C04 | N07 | C08 | 120.1° | 34.2° |
| C04 | C03 | C02 | H3 | 179.8° | 180.0° |
| C03 | C04 | C05 | H5 | 179.5° | 180.0° |
| C03 | C04 | N07 | H29 | 59.9° | 145.8° |
| C04 | N07 | C08 | C13 | 46.9° | 173.9° |
| C04 | N07 | C08 | H29 | 180.0° | 180.0° |
| C04 | N07 | C08 | N09 | 134.3° | 6.1° |
| N07 | C04 | C03 | H4 | 0.3° | 0.0° |
| N07 | C04 | C05 | H5 | 0.4° | 0.0° |
| C12 | C13 | C08 | H2 | 180.0° | 180.0° |
| C13 | C12 | C11 | CL14 | 179.8° | 180.0° |
| C13 | C12 | C11 | C10 | 0.1° | 0.0° |
| C12 | C13 | C08 | N07 | 179.4° | 180.0° |
| C12 | C13 | C08 | N09 | 0.6° | 0.0° |
| C11 | C12 | C13 | C08 | 0.1° | 0.0° |
| C12 | C11 | CL14 | C10 | 180.0° | 180.0° |
| C12 | C11 | C10 | N09 | 0.1° | 0.0° |
| C12 | C11 | C10 | H1 | 179.9° | 179.7° |
| C11 | C12 | C13 | H2 | 179.8° | 180.0° |
| C13 | C08 | N07 | N09 | 178.8° | 180.0° |
| C13 | C08 | N09 | C10 | 0.8° | 0.0° |
| C13 | C08 | N07 | H29 | 133.1° | 6.1° |
| CL14 | C11 | C10 | N09 | 180.0° | 180.0° |
| CL14 | C11 | C10 | H1 | 0.0° | 0.3° |
| C11 | C10 | N09 | C08 | 0.5° | 0.0° |
| C11 | C10 | N09 | H1 | 180.0° | 179.7° |
| N07 | C08 | N09 | C10 | 179.6° | 180.0° |
| N07 | C08 | C13 | H2 | 0.6° | 0.0° |
| C08 | N09 | C10 | H1 | 179.4° | 179.7° |
| N09 | C08 | C13 | H2 | 179.4° | 180.0° |
| N09 | C08 | N07 | H29 | 45.7° | 173.9° |
| H3 | C02 | C03 | H4 | 0.2° | 0.1° |
| H5 | C05 | C06 | H6 | 0.1° | 0.1° |
| H7 | C18 | C19 | H8 | 0.2° | 0.2° |
| H8 | C19 | C20 | H9 | 0.7° | 0.0° |
| H10 | C23 | C24 | H11 | 59.5° | 60.0° |
| H10 | C23 | C24 | H12 | 179.5° | 60.0° |
| H10 | C23 | C24 | H13 | 60.6° | 180.0° |
| H10 | C23 | C25 | H14 | 81.3° | 54.9° |
| H10 | C23 | C25 | H15 | 39.1° | 65.1° |
| H10 | C23 | N22 | H31 | 67.9° | 145.0° |
| H11 | C24 | H12 | H13 | 120.0° | 119.9° |
| H16 | C27 | H17 | H18 | 120.0° | 120.0° |
| H19 | C28 | N21 | H30 | 102.7° | 120.0° |
| H20 | C28 | N21 | H30 | 137.7° | 120.0° |
| H21 | C30 | C31 | H23 | 151.8° | 57.5° |
| H21 | C30 | C31 | H24 | 33.1° | 62.5° |
| H22 | C30 | C31 | H23 | 32.4° | 177.7° |
| H22 | C30 | C31 | H24 | 86.3° | 57.7° |
| H25 | C33 | C34 | H27 | 14.2° | 57.7° |
| H25 | C33 | C34 | H28 | 104.7° | 62.5° |
| H26 | C33 | C34 | H27 | 132.4° | 177.7° |
| H26 | C33 | C34 | H28 | 13.5° | 57.5° |
