UCE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C37 | C36 | sing | 1.53Å | 1.54Å | |
| C36 | C35 | sing | 1.51Å | 1.55Å | |
| C39 | C40 | doub | 1.38Å | 1.41Å | Aromatic |
| C39 | C33 | sing | 1.39Å | 1.42Å | Aromatic |
| N34 | C35 | sing | 1.35Å | 1.47Å | |
| N34 | C33 | sing | 1.40Å | 1.48Å | |
| C40 | C41 | sing | 1.39Å | 1.42Å | Aromatic |
| C35 | O38 | doub | 1.21Å | 1.19Å | |
| C33 | C32 | doub | 1.39Å | 1.41Å | Aromatic |
| C41 | N42 | sing | 1.39Å | 1.48Å | |
| C41 | C31 | doub | 1.40Å | 1.41Å | Aromatic |
| C32 | C31 | sing | 1.39Å | 1.42Å | Aromatic |
| N42 | C02 | sing | 1.35Å | 1.44Å | |
| C31 | N03 | sing | 1.39Å | 1.49Å | |
| C02 | N03 | sing | 1.35Å | 1.44Å | |
| C02 | O01 | doub | 1.22Å | 1.18Å | |
| N03 | C04 | sing | 1.47Å | 1.50Å | |
| C04 | C30 | sing | 1.53Å | 1.45Å | |
| C04 | C05 | sing | 1.53Å | 1.51Å | |
| C30 | C29 | sing | 1.53Å | 1.49Å | |
| C29 | N07 | sing | 1.47Å | 1.45Å | |
| C05 | C06 | sing | 1.53Å | 1.55Å | |
| N07 | C06 | sing | 1.47Å | 1.46Å | |
| N07 | C08 | sing | 1.47Å | 1.22Å | |
| C08 | C09 | sing | 1.51Å | 1.57Å | |
| C10 | C09 | doub | 1.38Å | 1.40Å | Aromatic |
| C10 | C11 | sing | 1.38Å | 1.41Å | Aromatic |
| C09 | C28 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | C12 | doub | 1.39Å | 1.41Å | Aromatic |
| C28 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| C12 | C27 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | C13 | sing | 1.48Å | 1.56Å | |
| C26 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| C26 | C21 | sing | 1.39Å | 1.40Å | Aromatic |
| C25 | C24 | sing | 1.38Å | 1.40Å | Aromatic |
| C13 | N14 | doub | 1.33Å | 1.33Å | Aromatic |
| C13 | C20 | sing | 1.40Å | 1.42Å | Aromatic |
| N14 | C15 | sing | 1.32Å | 1.33Å | Aromatic |
| C20 | C21 | sing | 1.48Å | 1.55Å | |
| C20 | C19 | doub | 1.40Å | 1.40Å | Aromatic |
| C21 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
| C24 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| C19 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
| C16 | C17 | sing | 1.51Å | 1.54Å | |
| C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| O18 | C17 | sing | 1.43Å | 1.41Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C15 | H2 | sing | 1.08Å | 1.08Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C22 | H5 | sing | 1.08Å | 1.08Å | |
| C24 | H6 | sing | 1.08Å | 1.08Å | |
| C26 | H7 | sing | 1.08Å | 1.08Å | |
| C28 | H8 | sing | 1.08Å | 1.08Å | |
| C04 | H9 | sing | 1.09Å | 1.10Å | |
| C05 | H10 | sing | 1.09Å | 1.10Å | |
| C05 | H11 | sing | 1.09Å | 1.10Å | |
| C06 | H12 | sing | 1.09Å | 1.10Å | |
| C06 | H13 | sing | 1.09Å | 1.10Å | |
| C08 | H14 | sing | 1.09Å | 1.10Å | |
| C08 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.08Å | 1.08Å | |
| C19 | H17 | sing | 1.08Å | 1.08Å | |
| C23 | H18 | sing | 1.08Å | 1.08Å | |
| C25 | H19 | sing | 1.08Å | 1.08Å | |
| C27 | H20 | sing | 1.08Å | 1.08Å | |
| C29 | H21 | sing | 1.09Å | 1.10Å | |
| C29 | H22 | sing | 1.09Å | 1.10Å | |
| C30 | H23 | sing | 1.09Å | 1.10Å | |
| C30 | H24 | sing | 1.09Å | 1.10Å | |
| C32 | H25 | sing | 1.08Å | 1.08Å | |
| C36 | H26 | sing | 1.09Å | 1.10Å | |
| C36 | H27 | sing | 1.09Å | 1.10Å | |
| C37 | H28 | sing | 1.09Å | 1.10Å | |
| C37 | H29 | sing | 1.09Å | 1.10Å | |
| C37 | H30 | sing | 1.09Å | 1.10Å | |
| C39 | H31 | sing | 1.08Å | 1.08Å | |
| C40 | H32 | sing | 1.08Å | 1.08Å | |
| N34 | H34 | sing | 0.97Å | 1.00Å | |
| N42 | H35 | sing | 0.97Å | 1.00Å | |
| O18 | H36 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C37 | C36 | C35 | 111.7° | 109.5° |
| C37 | C36 | H26 | 108.9° | 109.5° |
| C37 | C36 | H27 | 108.9° | 109.4° |
| C36 | C37 | H28 | 109.5° | 109.5° |
| C36 | C37 | H29 | 109.5° | 109.5° |
| C36 | C37 | H30 | 109.5° | 109.5° |
| C36 | C35 | N34 | 119.9° | 120.0° |
| C36 | C35 | O38 | 119.8° | 120.0° |
| C35 | C36 | H26 | 108.9° | 109.5° |
| C35 | C36 | H27 | 108.9° | 109.5° |
| C40 | C39 | C33 | 120.2° | 120.3° |
| C39 | C40 | C41 | 119.6° | 119.9° |
| C40 | C39 | H31 | 119.9° | 119.9° |
| C39 | C40 | H32 | 120.2° | 120.0° |
| C39 | C33 | N34 | 119.9° | 120.0° |
| C39 | C33 | C32 | 120.0° | 120.1° |
| C33 | C39 | H31 | 119.9° | 119.9° |
| C35 | N34 | C33 | 121.8° | 120.0° |
| N34 | C35 | O38 | 120.3° | 120.0° |
| C35 | N34 | H34 | 119.1° | 120.0° |
| N34 | C33 | C32 | 120.1° | 119.9° |
| C33 | N34 | H34 | 119.1° | 120.0° |
| C40 | C41 | N42 | 131.4° | 133.2° |
| C40 | C41 | C31 | 120.5° | 120.0° |
| C41 | C40 | H32 | 120.2° | 120.1° |
| C33 | C32 | C31 | 120.1° | 119.8° |
| C33 | C32 | H25 | 120.0° | 120.1° |
| N42 | C41 | C31 | 108.2° | 106.7° |
| C41 | N42 | C02 | 107.7° | 108.3° |
| C41 | N42 | H35 | 126.2° | 125.8° |
| C41 | C31 | C32 | 119.6° | 119.9° |
| C41 | C31 | N03 | 108.2° | 106.8° |
| C32 | C31 | N03 | 132.1° | 133.3° |
| C31 | C32 | H25 | 119.9° | 120.1° |
| N42 | C02 | N03 | 108.5° | 109.7° |
| N42 | C02 | O01 | 125.9° | 125.1° |
| C02 | N42 | H35 | 126.1° | 125.9° |
| C31 | N03 | C02 | 107.4° | 108.4° |
| C31 | N03 | C04 | 128.3° | 125.8° |
| N03 | C02 | O01 | 125.6° | 125.2° |
| C02 | N03 | C04 | 124.3° | 125.8° |
| N03 | C04 | C30 | 129.6° | 109.5° |
| N03 | C04 | C05 | 93.3° | 109.5° |
| N03 | C04 | H9 | 107.7° | 109.5° |
| C30 | C04 | C05 | 107.7° | 109.2° |
| C04 | C30 | C29 | 109.3° | 109.3° |
| C30 | C04 | H9 | 108.4° | 109.5° |
| C04 | C30 | H23 | 109.5° | 109.5° |
| C04 | C30 | H24 | 109.5° | 109.5° |
| C04 | C05 | C06 | 112.2° | 109.3° |
| C05 | C04 | H9 | 107.6° | 109.6° |
| C04 | C05 | H10 | 108.7° | 109.5° |
| C04 | C05 | H11 | 108.8° | 109.5° |
| C30 | C29 | N07 | 111.5° | 109.5° |
| C30 | C29 | H21 | 109.0° | 109.4° |
| C30 | C29 | H22 | 109.0° | 109.5° |
| C29 | C30 | H23 | 109.5° | 109.5° |
| C29 | C30 | H24 | 109.5° | 109.5° |
| C29 | N07 | C06 | 115.2° | 111.2° |
| C29 | N07 | C08 | 109.8° | 111.0° |
| N07 | C29 | H21 | 108.9° | 109.5° |
| N07 | C29 | H22 | 109.0° | 109.5° |
| C05 | C06 | N07 | 113.0° | 109.5° |
| C06 | C05 | H10 | 108.8° | 109.5° |
| C06 | C05 | H11 | 108.8° | 109.5° |
| C05 | C06 | H12 | 108.6° | 109.4° |
| C05 | C06 | H13 | 108.6° | 109.5° |
| C06 | N07 | C08 | 111.8° | 111.0° |
| N07 | C06 | H12 | 108.6° | 109.5° |
| N07 | C06 | H13 | 108.6° | 109.4° |
| N07 | C08 | C09 | 112.7° | 109.4° |
| N07 | C08 | H14 | 108.6° | 109.5° |
| N07 | C08 | H15 | 108.7° | 109.5° |
| C08 | C09 | C10 | 122.4° | 119.9° |
| C08 | C09 | C28 | 118.5° | 119.9° |
| C09 | C08 | H14 | 108.7° | 109.4° |
| C09 | C08 | H15 | 108.7° | 109.5° |
| C09 | C10 | C11 | 120.3° | 120.2° |
| C10 | C09 | C28 | 119.1° | 120.2° |
| C09 | C10 | H1 | 119.8° | 119.9° |
| C10 | C11 | C12 | 120.4° | 119.9° |
| C11 | C10 | H1 | 119.8° | 120.0° |
| C10 | C11 | H16 | 119.8° | 120.0° |
| C09 | C28 | C27 | 120.4° | 120.1° |
| C09 | C28 | H8 | 119.8° | 119.9° |
| C11 | C12 | C27 | 118.8° | 119.7° |
| C11 | C12 | C13 | 122.1° | 120.1° |
| C12 | C11 | H16 | 119.8° | 120.1° |
| C28 | C27 | C12 | 120.9° | 119.9° |
| C27 | C28 | H8 | 119.8° | 120.0° |
| C28 | C27 | H20 | 119.5° | 120.0° |
| C27 | C12 | C13 | 119.1° | 120.2° |
| C12 | C27 | H20 | 119.6° | 120.1° |
| C12 | C13 | N14 | 118.3° | 119.9° |
| C12 | C13 | C20 | 122.6° | 119.8° |
| C25 | C26 | C21 | 119.5° | 119.9° |
| C26 | C25 | C24 | 120.5° | 120.2° |
| C25 | C26 | H7 | 120.2° | 120.0° |
| C26 | C25 | H19 | 119.7° | 120.0° |
| C26 | C21 | C20 | 121.9° | 120.1° |
| C26 | C21 | C22 | 119.6° | 119.8° |
| C21 | C26 | H7 | 120.2° | 120.1° |
| C25 | C24 | C23 | 119.9° | 120.2° |
| C25 | C24 | H6 | 120.1° | 119.9° |
| C24 | C25 | H19 | 119.8° | 119.9° |
| N14 | C13 | C20 | 119.1° | 120.3° |
| C13 | N14 | C15 | 123.5° | 121.8° |
| C13 | C20 | C21 | 124.8° | 120.6° |
| C13 | C20 | C19 | 118.8° | 118.9° |
| N14 | C15 | C16 | 120.2° | 121.2° |
| N14 | C15 | H2 | 119.9° | 119.4° |
| C21 | C20 | C19 | 116.4° | 120.6° |
| C20 | C21 | C22 | 118.5° | 120.1° |
| C20 | C19 | C16 | 119.8° | 118.4° |
| C20 | C19 | H17 | 120.1° | 120.9° |
| C21 | C22 | C23 | 120.8° | 119.8° |
| C21 | C22 | H5 | 119.6° | 120.1° |
| C24 | C23 | C22 | 119.6° | 120.2° |
| C23 | C24 | H6 | 120.1° | 119.9° |
| C24 | C23 | H18 | 120.2° | 119.9° |
| C15 | C16 | C19 | 118.6° | 119.5° |
| C15 | C16 | C17 | 121.5° | 120.2° |
| C16 | C15 | H2 | 119.9° | 119.4° |
| C19 | C16 | C17 | 119.8° | 120.3° |
| C16 | C19 | H17 | 120.1° | 120.8° |
| C16 | C17 | O18 | 109.0° | 109.5° |
| C16 | C17 | H3 | 109.6° | 109.5° |
| C16 | C17 | H4 | 109.6° | 109.5° |
| C23 | C22 | H5 | 119.6° | 120.1° |
| C22 | C23 | H18 | 120.2° | 119.9° |
| O18 | C17 | H3 | 109.6° | 109.4° |
| O18 | C17 | H4 | 109.6° | 109.5° |
| C17 | O18 | H36 | 109.5° | 114.0° |
| H3 | C17 | H4 | 109.5° | 109.5° |
| H10 | C05 | H11 | 109.5° | 109.5° |
| H12 | C06 | H13 | 109.4° | 109.5° |
| H14 | C08 | H15 | 109.5° | 109.5° |
| H21 | C29 | H22 | 109.5° | 109.4° |
| H23 | C30 | H24 | 109.5° | 109.5° |
| H26 | C36 | H27 | 109.5° | 109.5° |
| H28 | C37 | H29 | 109.5° | 109.5° |
| H28 | C37 | H30 | 109.5° | 109.5° |
| H29 | C37 | H30 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C37 | C36 | C35 | H26 | 120.3° | 120.0° |
| C37 | C36 | C35 | H27 | 120.3° | 120.0° |
| C37 | C36 | C35 | N34 | 68.1° | 180.0° |
| C37 | C36 | C35 | O38 | 111.7° | 0.0° |
| C37 | C36 | H26 | H27 | 118.9° | 120.0° |
| C36 | C37 | H28 | H29 | 120.0° | 120.0° |
| C36 | C37 | H28 | H30 | 120.0° | 120.0° |
| C36 | C37 | H29 | H30 | 120.0° | 120.0° |
| C36 | C35 | N34 | O38 | 179.8° | 180.0° |
| C36 | C35 | N34 | C33 | 179.3° | 174.6° |
| C35 | C36 | H26 | H27 | 119.0° | 120.0° |
| C35 | C36 | C37 | H28 | 180.0° | 60.0° |
| C35 | C36 | C37 | H29 | 60.0° | 60.0° |
| C35 | C36 | C37 | H30 | 60.0° | 180.0° |
| C36 | C35 | N34 | H34 | 0.7° | 5.4° |
| C40 | C39 | C33 | H31 | 180.0° | 179.6° |
| C40 | C39 | C33 | N34 | 179.6° | 179.9° |
| C39 | C40 | C41 | H32 | 180.0° | 179.6° |
| C40 | C39 | C33 | C32 | 0.6° | 0.0° |
| C39 | C40 | C41 | N42 | 179.8° | 179.6° |
| C39 | C40 | C41 | C31 | 0.1° | 0.9° |
| C39 | C33 | N34 | C35 | 42.3° | 145.4° |
| C39 | C33 | N34 | C32 | 178.9° | 180.0° |
| C33 | C39 | C40 | C41 | 0.4° | 0.4° |
| C39 | C33 | C32 | C31 | 0.6° | 0.0° |
| C39 | C33 | C32 | H25 | 179.4° | 180.0° |
| C33 | C39 | C40 | H32 | 179.6° | 180.0° |
| C39 | C33 | N34 | H34 | 137.7° | 34.7° |
| C35 | N34 | C33 | H34 | 180.0° | 180.0° |
| C35 | N34 | C33 | C32 | 138.8° | 34.6° |
| N34 | C35 | C36 | H26 | 52.2° | 60.0° |
| N34 | C35 | C36 | H27 | 171.6° | 60.0° |
| C33 | N34 | C35 | O38 | 0.5° | 5.4° |
| N34 | C33 | C32 | C31 | 179.5° | 179.9° |
| N34 | C33 | C32 | H25 | 0.5° | 0.0° |
| N34 | C33 | C39 | H31 | 0.5° | 0.5° |
| C40 | C41 | N42 | C31 | 179.9° | 178.8° |
| C40 | C41 | C31 | C32 | 0.0° | 0.9° |
| C40 | C41 | N42 | C02 | 179.9° | 179.1° |
| C40 | C41 | C31 | N03 | 179.8° | 179.4° |
| C41 | C40 | C39 | H31 | 179.6° | 180.0° |
| C40 | C41 | N42 | H35 | 0.1° | 1.1° |
| O38 | C35 | C36 | H26 | 128.0° | 120.0° |
| O38 | C35 | C36 | H27 | 8.6° | 119.9° |
| O38 | C35 | N34 | H34 | 179.5° | 174.6° |
| C33 | C32 | C31 | C41 | 0.3° | 0.4° |
| C33 | C32 | C31 | H25 | 180.0° | 180.0° |
| C33 | C32 | C31 | N03 | 179.5° | 180.0° |
| C32 | C33 | C39 | H31 | 179.4° | 179.6° |
| C32 | C33 | N34 | H34 | 41.3° | 145.4° |
| N42 | C41 | C31 | C32 | 179.9° | 179.9° |
| C41 | N42 | C02 | H35 | 180.0° | 179.8° |
| N42 | C41 | C31 | N03 | 0.3° | 0.4° |
| C41 | N42 | C02 | N03 | 0.2° | 0.0° |
| C41 | N42 | C02 | O01 | 179.8° | 179.7° |
| N42 | C41 | C40 | H32 | 0.2° | 0.8° |
| C41 | C31 | C32 | N03 | 179.8° | 179.6° |
| C31 | C41 | N42 | C02 | 0.1° | 0.2° |
| C41 | C31 | N03 | C02 | 0.4° | 0.4° |
| C41 | C31 | N03 | C04 | 179.4° | 179.6° |
| C41 | C31 | C32 | H25 | 179.7° | 179.6° |
| C31 | C41 | C40 | H32 | 179.9° | 179.5° |
| C31 | C41 | N42 | H35 | 179.9° | 179.9° |
| C32 | C31 | N03 | C02 | 179.8° | 180.0° |
| C32 | C31 | N03 | C04 | 0.8° | 0.0° |
| N42 | C02 | N03 | C31 | 0.3° | 0.3° |
| N42 | C02 | N03 | O01 | 179.9° | 179.7° |
| N42 | C02 | N03 | C04 | 179.4° | 179.8° |
| C31 | N03 | C02 | C04 | 179.1° | 180.0° |
| C31 | N03 | C02 | O01 | 179.6° | 180.0° |
| C31 | N03 | C04 | C30 | 3.0° | 47.0° |
| C31 | N03 | C04 | C05 | 119.3° | 166.7° |
| C31 | N03 | C04 | H9 | 131.0° | 73.1° |
| N03 | C31 | C32 | H25 | 0.5° | 0.1° |
| C02 | N03 | C04 | C30 | 178.1° | 133.0° |
| C02 | N03 | C04 | C05 | 61.8° | 13.3° |
| C02 | N03 | C04 | H9 | 47.8° | 106.9° |
| N03 | C02 | N42 | H35 | 179.8° | 179.8° |
| O01 | C02 | N03 | C04 | 0.5° | 0.0° |
| O01 | C02 | N42 | H35 | 0.3° | 0.1° |
| N03 | C04 | C30 | C05 | 110.0° | 119.9° |
| N03 | C04 | C30 | H9 | 133.8° | 120.1° |
| N03 | C04 | C05 | H9 | 109.8° | 120.2° |
| N03 | C04 | C30 | C29 | 179.7° | 62.2° |
| N03 | C04 | C05 | C06 | 158.6° | 62.3° |
| N03 | C04 | C05 | H10 | 38.2° | 57.7° |
| N03 | C04 | C05 | H11 | 80.9° | 177.7° |
| N03 | C04 | C30 | H23 | 59.7° | 177.8° |
| N03 | C04 | C30 | H24 | 60.4° | 57.7° |
| C30 | C04 | C05 | H9 | 116.8° | 119.9° |
| C04 | C30 | C29 | H23 | 120.0° | 120.0° |
| C04 | C30 | C29 | H24 | 120.0° | 119.9° |
| C04 | C30 | C29 | N07 | 55.4° | 59.2° |
| C30 | C04 | C05 | C06 | 25.2° | 57.6° |
| C30 | C04 | C05 | H10 | 95.3° | 177.6° |
| C30 | C04 | C05 | H11 | 145.6° | 62.3° |
| C04 | C30 | C29 | H21 | 64.8° | 179.2° |
| C04 | C30 | C29 | H22 | 175.7° | 60.8° |
| C04 | C30 | H23 | H24 | 120.1° | 120.1° |
| C05 | C04 | C30 | C29 | 70.4° | 57.7° |
| C04 | C05 | C06 | H10 | 120.4° | 119.9° |
| C04 | C05 | C06 | H11 | 120.4° | 120.0° |
| C04 | C05 | C06 | N07 | 31.8° | 59.2° |
| C04 | C05 | H10 | H11 | 118.7° | 120.0° |
| C04 | C05 | C06 | H12 | 88.7° | 60.8° |
| C04 | C05 | C06 | H13 | 152.4° | 179.2° |
| C05 | C04 | C30 | H23 | 169.7° | 62.3° |
| C05 | C04 | C30 | H24 | 49.6° | 177.6° |
| C30 | C29 | N07 | H21 | 120.3° | 120.0° |
| C30 | C29 | N07 | H22 | 120.3° | 120.0° |
| C30 | C29 | N07 | C06 | 5.6° | 61.7° |
| C30 | C29 | N07 | C08 | 132.8° | 174.1° |
| C29 | C30 | C04 | H9 | 45.9° | 177.6° |
| C30 | C29 | H21 | H22 | 119.1° | 120.0° |
| C29 | C30 | H23 | H24 | 120.1° | 120.1° |
| C29 | N07 | C06 | C05 | 48.5° | 61.7° |
| C29 | N07 | C06 | C08 | 126.3° | 124.1° |
| C29 | N07 | C08 | C09 | 148.3° | 170.0° |
| C29 | N07 | C06 | H12 | 72.0° | 58.3° |
| C29 | N07 | C06 | H13 | 169.1° | 178.2° |
| C29 | N07 | C08 | H14 | 27.8° | 70.0° |
| C29 | N07 | C08 | H15 | 91.2° | 50.0° |
| N07 | C29 | H21 | H22 | 119.1° | 120.0° |
| N07 | C29 | C30 | H23 | 175.4° | 60.8° |
| N07 | C29 | C30 | H24 | 64.5° | 179.1° |
| C05 | C06 | N07 | H12 | 120.5° | 120.0° |
| C05 | C06 | N07 | H13 | 120.5° | 120.0° |
| C05 | C06 | N07 | C08 | 174.8° | 174.2° |
| C06 | C05 | C04 | H9 | 91.6° | 177.6° |
| C06 | C05 | H10 | H11 | 118.8° | 120.1° |
| C05 | C06 | H12 | H13 | 118.4° | 120.0° |
| C06 | N07 | C08 | C09 | 82.6° | 65.8° |
| N07 | C06 | C05 | H10 | 152.2° | 179.1° |
| N07 | C06 | C05 | H11 | 88.6° | 60.8° |
| N07 | C06 | H12 | H13 | 118.4° | 120.0° |
| C06 | N07 | C08 | H14 | 156.9° | 54.2° |
| C06 | N07 | C08 | H15 | 37.9° | 174.2° |
| C06 | N07 | C29 | H21 | 125.9° | 178.3° |
| C06 | N07 | C29 | H22 | 114.7° | 58.3° |
| N07 | C08 | C09 | H14 | 120.4° | 120.0° |
| N07 | C08 | C09 | H15 | 120.5° | 120.1° |
| N07 | C08 | C09 | C10 | 37.0° | 90.0° |
| N07 | C08 | C09 | C28 | 143.1° | 90.0° |
| C08 | N07 | C06 | H12 | 54.3° | 65.8° |
| C08 | N07 | C06 | H13 | 64.7° | 54.2° |
| N07 | C08 | H14 | H15 | 118.5° | 120.1° |
| C08 | N07 | C29 | H21 | 106.9° | 54.1° |
| C08 | N07 | C29 | H22 | 12.5° | 65.8° |
| C08 | C09 | C10 | C28 | 179.9° | 180.0° |
| C08 | C09 | C10 | C11 | 179.8° | 180.0° |
| C08 | C09 | C28 | C27 | 179.9° | 180.0° |
| C08 | C09 | C10 | H1 | 0.2° | 0.4° |
| C08 | C09 | C28 | H8 | 0.1° | 0.0° |
| C09 | C08 | H14 | H15 | 118.5° | 120.0° |
| C09 | C10 | C11 | H1 | 180.0° | 179.6° |
| C09 | C10 | C11 | C12 | 1.0° | 0.1° |
| C10 | C09 | C28 | C27 | 0.2° | 0.0° |
| C10 | C09 | C28 | H8 | 179.8° | 180.0° |
| C10 | C09 | C08 | H14 | 83.5° | 150.0° |
| C10 | C09 | C08 | H15 | 157.5° | 30.0° |
| C09 | C10 | C11 | H16 | 179.0° | 180.0° |
| C11 | C10 | C09 | C28 | 0.3° | 0.0° |
| C10 | C11 | C12 | H16 | 180.0° | 179.9° |
| C10 | C11 | C12 | C27 | 1.6° | 0.1° |
| C10 | C11 | C12 | C13 | 179.4° | 180.0° |
| C09 | C28 | C27 | H8 | 180.0° | 180.0° |
| C09 | C28 | C27 | C12 | 0.9° | 0.0° |
| C28 | C09 | C10 | H1 | 179.7° | 179.7° |
| C28 | C09 | C08 | H14 | 96.5° | 30.0° |
| C28 | C09 | C08 | H15 | 22.6° | 150.0° |
| C09 | C28 | C27 | H20 | 179.2° | 180.0° |
| C11 | C12 | C27 | C28 | 1.6° | 0.1° |
| C11 | C12 | C27 | C13 | 177.9° | 179.9° |
| C11 | C12 | C13 | N14 | 49.2° | 35.0° |
| C11 | C12 | C13 | C20 | 131.7° | 144.8° |
| C12 | C11 | C10 | H1 | 179.0° | 179.7° |
| C11 | C12 | C27 | H20 | 178.5° | 180.0° |
| C28 | C27 | C12 | H20 | 180.0° | 179.9° |
| C28 | C27 | C12 | C13 | 179.4° | 180.0° |
| C27 | C12 | C13 | N14 | 128.6° | 144.9° |
| C27 | C12 | C13 | C20 | 50.5° | 35.3° |
| C12 | C27 | C28 | H8 | 179.1° | 180.0° |
| C27 | C12 | C11 | H16 | 178.4° | 180.0° |
| C12 | C13 | N14 | C20 | 179.1° | 179.8° |
| C12 | C13 | N14 | C15 | 179.4° | 179.7° |
| C12 | C13 | C20 | C21 | 0.8° | 0.2° |
| C12 | C13 | C20 | C19 | 179.3° | 179.7° |
| C13 | C12 | C11 | H16 | 0.6° | 0.1° |
| C13 | C12 | C27 | H20 | 0.6° | 0.1° |
| C25 | C26 | C21 | H7 | 180.0° | 179.9° |
| C26 | C25 | C24 | H19 | 180.0° | 179.9° |
| C25 | C26 | C21 | C20 | 179.5° | 180.0° |
| C25 | C26 | C21 | C22 | 0.8° | 0.2° |
| C26 | C25 | C24 | C23 | 0.2° | 0.4° |
| C26 | C25 | C24 | H6 | 179.8° | 180.0° |
| C21 | C26 | C25 | C24 | 0.5° | 0.1° |
| C26 | C21 | C20 | C13 | 50.5° | 50.2° |
| C26 | C21 | C20 | C22 | 178.7° | 179.8° |
| C26 | C21 | C20 | C19 | 129.4° | 129.7° |
| C26 | C21 | C22 | C23 | 0.8° | 0.3° |
| C26 | C21 | C22 | H5 | 179.2° | 179.8° |
| C21 | C26 | C25 | H19 | 179.5° | 180.0° |
| C25 | C24 | C23 | H6 | 180.0° | 179.7° |
| C25 | C24 | C23 | C22 | 0.2° | 0.3° |
| C24 | C25 | C26 | H7 | 179.5° | 180.0° |
| C25 | C24 | C23 | H18 | 179.8° | 179.7° |
| N14 | C13 | C20 | C21 | 179.9° | 179.9° |
| N14 | C13 | C20 | C19 | 0.3° | 0.1° |
| C13 | N14 | C15 | C16 | 0.0° | 0.1° |
| C13 | N14 | C15 | H2 | 180.0° | 180.0° |
| C20 | C13 | N14 | C15 | 0.3° | 0.1° |
| C13 | C20 | C21 | C19 | 179.9° | 179.9° |
| C13 | C20 | C21 | C22 | 130.7° | 130.0° |
| C13 | C20 | C19 | C16 | 0.1° | 0.1° |
| C13 | C20 | C19 | H17 | 179.9° | 180.0° |
| N14 | C15 | C16 | H2 | 180.0° | 179.9° |
| N14 | C15 | C16 | C19 | 0.4° | 0.1° |
| N14 | C15 | C16 | C17 | 179.7° | 180.0° |
| C21 | C20 | C19 | C16 | 179.8° | 179.9° |
| C20 | C21 | C22 | C23 | 179.5° | 180.0° |
| C20 | C21 | C22 | H5 | 0.5° | 0.0° |
| C20 | C21 | C26 | H7 | 0.5° | 0.1° |
| C21 | C20 | C19 | H17 | 0.2° | 0.0° |
| C19 | C20 | C21 | C22 | 49.4° | 50.0° |
| C20 | C19 | C16 | C15 | 0.4° | 0.1° |
| C20 | C19 | C16 | H17 | 180.0° | 179.9° |
| C20 | C19 | C16 | C17 | 179.8° | 180.0° |
| C21 | C22 | C23 | C24 | 0.5° | 0.0° |
| C21 | C22 | C23 | H5 | 180.0° | 180.0° |
| C22 | C21 | C26 | H7 | 179.2° | 179.7° |
| C21 | C22 | C23 | H18 | 179.5° | 180.0° |
| C24 | C23 | C22 | H18 | 180.0° | 180.0° |
| C24 | C23 | C22 | H5 | 179.5° | 180.0° |
| C23 | C24 | C25 | H19 | 179.8° | 179.7° |
| C15 | C16 | C19 | C17 | 179.4° | 179.9° |
| C15 | C16 | C17 | O18 | 2.6° | 90.0° |
| C15 | C16 | C17 | H3 | 117.3° | 150.1° |
| C15 | C16 | C17 | H4 | 122.5° | 30.1° |
| C15 | C16 | C19 | H17 | 179.6° | 180.0° |
| C19 | C16 | C17 | O18 | 176.8° | 89.9° |
| C19 | C16 | C15 | H2 | 179.6° | 180.0° |
| C19 | C16 | C17 | H3 | 63.3° | 30.1° |
| C19 | C16 | C17 | H4 | 56.9° | 150.1° |
| C16 | C17 | O18 | H3 | 119.9° | 120.0° |
| C16 | C17 | O18 | H4 | 119.9° | 120.0° |
| C17 | C16 | C15 | H2 | 0.3° | 0.1° |
| C16 | C17 | H3 | H4 | 120.2° | 120.0° |
| C17 | C16 | C19 | H17 | 0.2° | 0.1° |
| C16 | C17 | O18 | H36 | 180.0° | 180.0° |
| C22 | C23 | C24 | H6 | 179.8° | 180.0° |
| O18 | C17 | H3 | H4 | 120.2° | 120.0° |
| H1 | C10 | C11 | H16 | 1.0° | 0.4° |
| H3 | C17 | O18 | H36 | 60.1° | 60.0° |
| H4 | C17 | O18 | H36 | 60.1° | 60.0° |
| H5 | C22 | C23 | H18 | 0.5° | 0.0° |
| H6 | C24 | C23 | H18 | 0.2° | 0.1° |
| H6 | C24 | C25 | H19 | 0.2° | 0.1° |
| H7 | C26 | C25 | H19 | 0.5° | 0.1° |
| H8 | C28 | C27 | H20 | 0.8° | 0.0° |
| H9 | C04 | C05 | H10 | 148.0° | 62.5° |
| H9 | C04 | C05 | H11 | 28.8° | 57.6° |
| H9 | C04 | C30 | H23 | 74.1° | 57.6° |
| H9 | C04 | C30 | H24 | 165.8° | 62.5° |
| H10 | C05 | C06 | H12 | 31.6° | 59.1° |
| H10 | C05 | C06 | H13 | 87.3° | 60.9° |
| H11 | C05 | C06 | H12 | 150.8° | 179.2° |
| H11 | C05 | C06 | H13 | 31.9° | 59.2° |
| H21 | C29 | C30 | H23 | 55.1° | 59.2° |
| H21 | C29 | C30 | H24 | 175.2° | 60.9° |
| H22 | C29 | C30 | H23 | 64.3° | 179.2° |
| H22 | C29 | C30 | H24 | 55.8° | 59.1° |
| H26 | C36 | C37 | H28 | 59.7° | 180.0° |
| H26 | C36 | C37 | H29 | 60.4° | 60.0° |
| H26 | C36 | C37 | H30 | 179.7° | 60.0° |
| H27 | C36 | C37 | H28 | 59.7° | 60.0° |
| H27 | C36 | C37 | H29 | 179.7° | 180.0° |
| H27 | C36 | C37 | H30 | 60.4° | 60.0° |
| H28 | C37 | H29 | H30 | 120.0° | 120.0° |
| H31 | C39 | C40 | H32 | 0.4° | 0.4° |
