A1L07
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C25 | N24 | sing | 1.47Å | 1.42Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| C23 | N24 | sing | 1.47Å | 1.54Å | |
| C12 | C11 | sing | 1.53Å | 1.53Å | |
| C11 | C10 | sing | 1.53Å | 1.54Å | |
| N24 | C26 | sing | 1.47Å | 1.54Å | |
| C21 | C27 | sing | 1.53Å | 1.53Å | |
| C21 | O20 | sing | 1.43Å | 1.45Å | |
| C27 | C26 | sing | 1.53Å | 1.53Å | |
| O06 | C05 | doub | 1.22Å | 1.23Å | |
| C17 | C18 | doub | 1.38Å | 1.43Å | Aromatic |
| C17 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
| N15 | C16 | sing | 1.40Å | 1.45Å | |
| N15 | C13 | sing | 1.35Å | 1.43Å | |
| C10 | C09 | sing | 1.53Å | 1.56Å | |
| C18 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C16 | C29 | doub | 1.39Å | 1.42Å | Aromatic |
| C19 | O20 | sing | 1.36Å | 1.38Å | |
| C19 | C28 | doub | 1.39Å | 1.40Å | Aromatic |
| C29 | C28 | sing | 1.38Å | 1.44Å | Aromatic |
| C38 | C36 | sing | 1.53Å | 1.52Å | |
| C08 | C09 | sing | 1.53Å | 1.56Å | |
| C08 | C13 | sing | 1.51Å | 1.64Å | |
| C08 | N07 | sing | 1.46Å | 1.50Å | |
| C05 | N07 | sing | 1.35Å | 1.40Å | |
| C05 | C04 | sing | 1.47Å | 1.48Å | |
| C13 | O14 | doub | 1.21Å | 1.23Å | |
| N03 | C04 | sing | 1.38Å | 1.40Å | Aromatic |
| N03 | C02 | sing | 1.33Å | 1.40Å | Aromatic |
| C04 | C30 | doub | 1.37Å | 1.42Å | Aromatic |
| C01 | C02 | sing | 1.51Å | 1.50Å | |
| C01 | C36 | sing | 1.53Å | 1.55Å | |
| C02 | C32 | doub | 1.40Å | 1.39Å | Aromatic |
| C36 | C37 | sing | 1.53Å | 1.54Å | |
| C36 | C35 | sing | 1.53Å | 1.54Å | |
| C30 | C32 | sing | 1.40Å | 1.45Å | Aromatic |
| C30 | C31 | sing | 1.51Å | 1.48Å | |
| C32 | C33 | sing | 1.47Å | 1.47Å | |
| C35 | C33 | sing | 1.52Å | 1.54Å | |
| C33 | O34 | doub | 1.21Å | 1.22Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| N03 | H3 | sing | 0.97Å | 1.00Å | |
| N07 | H4 | sing | 0.97Å | 1.00Å | |
| C08 | H5 | sing | 1.09Å | 1.10Å | |
| C09 | H6 | sing | 1.09Å | 1.10Å | |
| C09 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| N15 | H15 | sing | 0.97Å | 1.00Å | |
| C17 | H16 | sing | 1.08Å | 1.08Å | |
| C18 | H17 | sing | 1.08Å | 1.08Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H27 | sing | 1.09Å | 1.10Å | |
| C26 | H28 | sing | 1.09Å | 1.10Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C28 | H31 | sing | 1.08Å | 1.08Å | |
| C29 | H32 | sing | 1.08Å | 1.08Å | |
| C31 | H33 | sing | 1.09Å | 1.10Å | |
| C31 | H34 | sing | 1.09Å | 1.10Å | |
| C31 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H36 | sing | 1.09Å | 1.10Å | |
| C35 | H37 | sing | 1.09Å | 1.10Å | |
| C37 | H38 | sing | 1.09Å | 1.10Å | |
| C37 | H39 | sing | 1.09Å | 1.10Å | |
| C37 | H40 | sing | 1.09Å | 1.10Å | |
| C38 | H41 | sing | 1.09Å | 1.10Å | |
| C38 | H42 | sing | 1.09Å | 1.10Å | |
| C38 | H43 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | N24 | C23 | 110.0° | 111.0° |
| C25 | N24 | C26 | 109.8° | 111.0° |
| N24 | C25 | H24 | 109.5° | 109.4° |
| N24 | C25 | H25 | 109.4° | 109.5° |
| N24 | C25 | H26 | 109.5° | 109.5° |
| C23 | C22 | C21 | 109.9° | 109.3° |
| C22 | C23 | N24 | 113.5° | 109.5° |
| C23 | C22 | H19 | 109.4° | 109.5° |
| C23 | C22 | H20 | 109.3° | 109.5° |
| C22 | C23 | H21 | 108.5° | 109.5° |
| C22 | C23 | H22 | 108.5° | 109.5° |
| C22 | C21 | C27 | 104.0° | 109.1° |
| C22 | C21 | O20 | 114.2° | 109.5° |
| C22 | C21 | H18 | 108.3° | 109.6° |
| C21 | C22 | H19 | 109.4° | 109.5° |
| C21 | C22 | H20 | 109.4° | 109.5° |
| C23 | N24 | C26 | 106.3° | 111.2° |
| N24 | C23 | H21 | 108.5° | 109.5° |
| N24 | C23 | H22 | 108.4° | 109.4° |
| C12 | C11 | C10 | 111.7° | 109.4° |
| C12 | C11 | H10 | 108.9° | 109.5° |
| C12 | C11 | H11 | 108.9° | 109.5° |
| C11 | C12 | H12 | 109.5° | 109.5° |
| C11 | C12 | H13 | 109.5° | 109.5° |
| C11 | C12 | H14 | 109.5° | 109.4° |
| C11 | C10 | C09 | 113.2° | 109.5° |
| C11 | C10 | H8 | 108.5° | 109.5° |
| C11 | C10 | H9 | 108.5° | 109.5° |
| C10 | C11 | H10 | 108.9° | 109.4° |
| C10 | C11 | H11 | 108.9° | 109.4° |
| N24 | C26 | C27 | 113.0° | 109.5° |
| N24 | C26 | H27 | 108.6° | 109.5° |
| N24 | C26 | H28 | 108.6° | 109.5° |
| C27 | C21 | O20 | 112.1° | 109.5° |
| C21 | C27 | C26 | 109.3° | 109.3° |
| C27 | C21 | H18 | 108.4° | 109.5° |
| C21 | C27 | H29 | 109.5° | 109.6° |
| C21 | C27 | H30 | 109.5° | 109.5° |
| C21 | O20 | C19 | 117.1° | 117.0° |
| O20 | C21 | H18 | 109.5° | 109.5° |
| C27 | C26 | H27 | 108.6° | 109.5° |
| C27 | C26 | H28 | 108.6° | 109.4° |
| C26 | C27 | H29 | 109.5° | 109.5° |
| C26 | C27 | H30 | 109.5° | 109.5° |
| O06 | C05 | N07 | 118.4° | 120.0° |
| O06 | C05 | C04 | 115.9° | 120.0° |
| C18 | C17 | C16 | 122.9° | 119.9° |
| C17 | C18 | C19 | 120.9° | 120.0° |
| C18 | C17 | H16 | 118.6° | 120.1° |
| C17 | C18 | H17 | 119.6° | 120.0° |
| C17 | C16 | N15 | 120.9° | 120.0° |
| C17 | C16 | C29 | 116.5° | 120.0° |
| C16 | C17 | H16 | 118.6° | 120.0° |
| C16 | N15 | C13 | 129.7° | 120.0° |
| N15 | C16 | C29 | 122.6° | 120.1° |
| C16 | N15 | H15 | 115.2° | 120.0° |
| N15 | C13 | C08 | 121.1° | 120.0° |
| N15 | C13 | O14 | 121.8° | 120.0° |
| C13 | N15 | H15 | 115.1° | 120.0° |
| C10 | C09 | C08 | 110.5° | 109.5° |
| C10 | C09 | H6 | 109.2° | 109.5° |
| C10 | C09 | H7 | 109.2° | 109.5° |
| C09 | C10 | H8 | 108.5° | 109.5° |
| C09 | C10 | H9 | 108.5° | 109.5° |
| C18 | C19 | O20 | 118.7° | 120.0° |
| C18 | C19 | C28 | 117.0° | 120.0° |
| C19 | C18 | H17 | 119.6° | 120.0° |
| C16 | C29 | C28 | 120.8° | 120.0° |
| C16 | C29 | H32 | 119.6° | 120.0° |
| O20 | C19 | C28 | 124.3° | 120.0° |
| C19 | C28 | C29 | 122.0° | 120.0° |
| C19 | C28 | H31 | 119.0° | 120.0° |
| C29 | C28 | H31 | 119.0° | 120.0° |
| C28 | C29 | H32 | 119.6° | 120.0° |
| C38 | C36 | C01 | 108.7° | 109.2° |
| C38 | C36 | C37 | 108.1° | 109.2° |
| C38 | C36 | C35 | 108.0° | 109.2° |
| C36 | C38 | H41 | 109.5° | 109.5° |
| C36 | C38 | H42 | 109.5° | 109.5° |
| C36 | C38 | H43 | 109.5° | 109.5° |
| C09 | C08 | C13 | 111.3° | 109.5° |
| C09 | C08 | N07 | 110.5° | 109.4° |
| C09 | C08 | H5 | 107.4° | 109.4° |
| C08 | C09 | H6 | 109.2° | 109.5° |
| C08 | C09 | H7 | 109.2° | 109.4° |
| C13 | C08 | N07 | 112.8° | 109.5° |
| C08 | C13 | O14 | 117.1° | 120.0° |
| C13 | C08 | H5 | 106.5° | 109.5° |
| C08 | N07 | C05 | 120.1° | 120.0° |
| C08 | N07 | H4 | 120.0° | 120.0° |
| N07 | C08 | H5 | 108.0° | 109.5° |
| N07 | C05 | C04 | 125.7° | 120.0° |
| C05 | N07 | H4 | 120.0° | 120.0° |
| C05 | C04 | N03 | 122.4° | 125.7° |
| C05 | C04 | C30 | 129.5° | 125.8° |
| C04 | N03 | C02 | 110.0° | 109.3° |
| N03 | C04 | C30 | 108.1° | 108.5° |
| C04 | N03 | H3 | 125.0° | 125.4° |
| N03 | C02 | C01 | 128.6° | 129.2° |
| N03 | C02 | C32 | 106.7° | 107.9° |
| C02 | N03 | H3 | 125.0° | 125.3° |
| C04 | C30 | C32 | 105.3° | 106.6° |
| C04 | C30 | C31 | 129.0° | 126.7° |
| C02 | C01 | C36 | 113.5° | 109.2° |
| C01 | C02 | C32 | 124.7° | 122.9° |
| C02 | C01 | H1 | 108.5° | 109.5° |
| C02 | C01 | H2 | 108.5° | 109.5° |
| C01 | C36 | C37 | 111.8° | 109.2° |
| C01 | C36 | C35 | 109.0° | 110.8° |
| C36 | C01 | H1 | 108.5° | 109.5° |
| C36 | C01 | H2 | 108.5° | 109.6° |
| C02 | C32 | C30 | 109.9° | 107.7° |
| C02 | C32 | C33 | 117.4° | 121.6° |
| C37 | C36 | C35 | 111.1° | 109.2° |
| C36 | C37 | H38 | 109.5° | 109.4° |
| C36 | C37 | H39 | 109.5° | 109.5° |
| C36 | C37 | H40 | 109.5° | 109.5° |
| C36 | C35 | C33 | 115.1° | 108.4° |
| C36 | C35 | H36 | 108.1° | 109.7° |
| C36 | C35 | H37 | 108.0° | 109.7° |
| C32 | C30 | C31 | 125.8° | 126.7° |
| C30 | C32 | C33 | 132.6° | 130.7° |
| C30 | C31 | H33 | 109.5° | 109.5° |
| C30 | C31 | H34 | 109.5° | 109.5° |
| C30 | C31 | H35 | 109.4° | 109.5° |
| C32 | C33 | C35 | 120.2° | 115.1° |
| C32 | C33 | O34 | 122.6° | 122.4° |
| C35 | C33 | O34 | 117.2° | 122.5° |
| C33 | C35 | H36 | 108.0° | 109.7° |
| C33 | C35 | H37 | 108.1° | 109.7° |
| H1 | C01 | H2 | 109.5° | 109.6° |
| H6 | C09 | H7 | 109.5° | 109.5° |
| H8 | C10 | H9 | 109.5° | 109.5° |
| H10 | C11 | H11 | 109.5° | 109.5° |
| H12 | C12 | H13 | 109.5° | 109.5° |
| H12 | C12 | H14 | 109.5° | 109.5° |
| H13 | C12 | H14 | 109.5° | 109.5° |
| H19 | C22 | H20 | 109.5° | 109.5° |
| H21 | C23 | H22 | 109.5° | 109.5° |
| H24 | C25 | H25 | 109.5° | 109.5° |
| H24 | C25 | H26 | 109.5° | 109.5° |
| H25 | C25 | H26 | 109.5° | 109.5° |
| H27 | C26 | H28 | 109.5° | 109.5° |
| H29 | C27 | H30 | 109.5° | 109.5° |
| H33 | C31 | H34 | 109.5° | 109.5° |
| H33 | C31 | H35 | 109.5° | 109.4° |
| H34 | C31 | H35 | 109.5° | 109.4° |
| H36 | C35 | H37 | 109.5° | 109.7° |
| H38 | C37 | H39 | 109.5° | 109.5° |
| H38 | C37 | H40 | 109.5° | 109.5° |
| H39 | C37 | H40 | 109.5° | 109.5° |
| H41 | C38 | H42 | 109.5° | 109.5° |
| H41 | C38 | H43 | 109.5° | 109.4° |
| H42 | C38 | H43 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | N24 | C23 | C22 | 66.1° | 174.2° |
| C25 | N24 | C23 | C26 | 118.9° | 124.1° |
| C25 | N24 | C26 | C27 | 64.7° | 174.1° |
| C25 | N24 | C23 | H21 | 54.5° | 65.8° |
| C25 | N24 | C23 | H22 | 173.3° | 54.2° |
| N24 | C25 | H24 | H25 | 120.0° | 120.0° |
| N24 | C25 | H24 | H26 | 120.0° | 120.0° |
| N24 | C25 | H25 | H26 | 120.0° | 120.0° |
| C25 | N24 | C26 | H27 | 55.8° | 65.8° |
| C25 | N24 | C26 | H28 | 174.8° | 54.2° |
| C23 | C22 | C21 | H19 | 120.1° | 120.0° |
| C23 | C22 | C21 | H20 | 120.1° | 120.0° |
| C22 | C23 | N24 | H21 | 120.6° | 120.0° |
| C22 | C23 | N24 | H22 | 120.6° | 120.0° |
| C22 | C23 | N24 | C26 | 52.7° | 61.7° |
| C23 | C22 | C21 | C27 | 63.5° | 57.7° |
| C23 | C22 | C21 | O20 | 58.9° | 177.6° |
| C23 | C22 | C21 | H18 | 178.7° | 62.3° |
| C23 | C22 | H19 | H20 | 119.8° | 120.1° |
| C22 | C23 | H21 | H22 | 118.2° | 120.0° |
| C21 | C22 | C23 | N24 | 61.0° | 59.2° |
| C22 | C21 | C27 | O20 | 123.8° | 119.9° |
| C22 | C21 | C27 | H18 | 115.1° | 120.0° |
| C22 | C21 | O20 | H18 | 121.7° | 120.2° |
| C22 | C21 | C27 | C26 | 64.9° | 57.7° |
| C22 | C21 | O20 | C19 | 65.3° | 84.3° |
| C21 | C22 | H19 | H20 | 119.8° | 120.1° |
| C21 | C22 | C23 | H21 | 178.4° | 60.9° |
| C21 | C22 | C23 | H22 | 59.6° | 179.2° |
| C22 | C21 | C27 | H29 | 175.1° | 62.3° |
| C22 | C21 | C27 | H30 | 55.1° | 177.5° |
| C23 | N24 | C26 | C27 | 54.2° | 61.8° |
| N24 | C23 | C22 | H19 | 178.9° | 179.1° |
| N24 | C23 | C22 | H20 | 59.1° | 60.8° |
| N24 | C23 | H21 | H22 | 118.1° | 120.0° |
| C23 | N24 | C25 | H24 | 180.0° | 60.0° |
| C23 | N24 | C25 | H25 | 60.0° | 180.0° |
| C23 | N24 | C25 | H26 | 60.0° | 60.0° |
| C23 | N24 | C26 | H27 | 174.7° | 58.3° |
| C23 | N24 | C26 | H28 | 66.3° | 178.3° |
| C12 | C11 | C10 | H10 | 120.3° | 120.0° |
| C12 | C11 | C10 | H11 | 120.3° | 120.0° |
| C12 | C11 | C10 | C09 | 72.1° | 180.0° |
| C12 | C11 | C10 | H8 | 48.5° | 60.0° |
| C12 | C11 | C10 | H9 | 167.3° | 60.0° |
| C12 | C11 | H10 | H11 | 119.0° | 120.1° |
| C11 | C12 | H12 | H13 | 120.0° | 120.0° |
| C11 | C12 | H12 | H14 | 120.0° | 120.0° |
| C11 | C12 | H13 | H14 | 120.0° | 120.0° |
| C11 | C10 | C09 | H8 | 120.6° | 120.0° |
| C11 | C10 | C09 | H9 | 120.6° | 120.0° |
| C11 | C10 | C09 | C08 | 70.8° | 180.0° |
| C11 | C10 | C09 | H6 | 49.4° | 60.0° |
| C11 | C10 | C09 | H7 | 169.1° | 60.1° |
| C11 | C10 | H8 | H9 | 118.3° | 120.0° |
| C10 | C11 | H10 | H11 | 119.0° | 120.0° |
| C10 | C11 | C12 | H12 | 180.0° | 60.0° |
| C10 | C11 | C12 | H13 | 60.0° | 60.0° |
| C10 | C11 | C12 | H14 | 60.0° | 180.0° |
| N24 | C26 | C27 | C21 | 64.0° | 59.2° |
| N24 | C26 | C27 | H27 | 120.5° | 120.0° |
| N24 | C26 | C27 | H28 | 120.5° | 120.0° |
| C26 | N24 | C23 | H21 | 173.3° | 58.3° |
| C26 | N24 | C23 | H22 | 67.9° | 178.3° |
| C26 | N24 | C25 | H24 | 63.3° | 175.8° |
| C26 | N24 | C25 | H25 | 56.7° | 55.8° |
| C26 | N24 | C25 | H26 | 176.7° | 64.2° |
| N24 | C26 | H27 | H28 | 118.4° | 120.0° |
| N24 | C26 | C27 | H29 | 176.0° | 60.8° |
| N24 | C26 | C27 | H30 | 55.9° | 179.1° |
| C27 | C21 | O20 | H18 | 120.4° | 120.2° |
| C21 | C27 | C26 | H29 | 120.0° | 120.0° |
| C21 | C27 | C26 | H30 | 119.9° | 119.9° |
| C27 | C21 | O20 | C19 | 176.8° | 156.0° |
| C27 | C21 | C22 | H19 | 176.4° | 177.7° |
| C27 | C21 | C22 | H20 | 56.5° | 62.3° |
| C21 | C27 | C26 | H27 | 175.5° | 60.8° |
| C21 | C27 | C26 | H28 | 56.5° | 179.2° |
| C21 | C27 | H29 | H30 | 120.1° | 120.1° |
| O20 | C21 | C27 | C26 | 58.9° | 177.6° |
| C21 | O20 | C19 | C18 | 108.6° | 4.4° |
| C21 | O20 | C19 | C28 | 71.4° | 175.6° |
| O20 | C21 | C22 | H19 | 61.1° | 62.4° |
| O20 | C21 | C22 | H20 | 179.0° | 57.6° |
| O20 | C21 | C27 | H29 | 61.0° | 57.6° |
| O20 | C21 | C27 | H30 | 178.9° | 62.6° |
| C26 | C27 | C21 | H18 | 180.0° | 62.3° |
| C27 | C26 | H27 | H28 | 118.4° | 119.9° |
| C26 | C27 | H29 | H30 | 120.1° | 120.1° |
| O06 | C05 | N07 | C08 | 2.7° | 0.1° |
| O06 | C05 | N07 | C04 | 179.8° | 180.0° |
| O06 | C05 | C04 | N03 | 3.9° | 180.0° |
| O06 | C05 | C04 | C30 | 172.7° | 0.0° |
| O06 | C05 | N07 | H4 | 177.4° | 180.0° |
| C18 | C17 | C16 | H16 | 180.0° | 180.0° |
| C18 | C17 | C16 | N15 | 179.8° | 180.0° |
| C17 | C18 | C19 | H17 | 180.0° | 180.0° |
| C18 | C17 | C16 | C29 | 0.2° | 0.2° |
| C17 | C18 | C19 | O20 | 180.0° | 179.9° |
| C17 | C18 | C19 | C28 | 0.1° | 0.0° |
| C17 | C16 | N15 | C29 | 179.5° | 179.8° |
| C17 | C16 | N15 | C13 | 128.7° | 144.5° |
| C16 | C17 | C18 | C19 | 0.1° | 0.1° |
| C17 | C16 | C29 | C28 | 0.2° | 0.5° |
| C17 | C16 | N15 | H15 | 51.3° | 35.4° |
| C16 | C17 | C18 | H17 | 179.9° | 180.0° |
| C17 | C16 | C29 | H32 | 179.8° | 179.8° |
| C16 | N15 | C13 | H15 | 180.0° | 180.0° |
| N15 | C16 | C29 | C28 | 179.8° | 179.7° |
| C16 | N15 | C13 | C08 | 178.6° | 175.8° |
| C16 | N15 | C13 | O14 | 1.2° | 4.2° |
| N15 | C16 | C17 | H16 | 0.2° | 0.0° |
| N15 | C16 | C29 | H32 | 0.2° | 0.0° |
| C13 | N15 | C16 | C29 | 51.8° | 35.2° |
| N15 | C13 | C08 | C09 | 80.3° | 60.0° |
| N15 | C13 | C08 | O14 | 179.8° | 180.0° |
| N15 | C13 | C08 | N07 | 154.8° | 180.0° |
| N15 | C13 | C08 | H5 | 36.5° | 60.0° |
| C10 | C09 | C08 | H6 | 120.1° | 120.0° |
| C10 | C09 | C08 | H7 | 120.2° | 119.9° |
| C10 | C09 | C08 | C13 | 160.5° | 175.0° |
| C10 | C09 | C08 | N07 | 73.3° | 65.0° |
| C10 | C09 | C08 | H5 | 44.3° | 54.9° |
| C10 | C09 | H6 | H7 | 119.5° | 120.0° |
| C09 | C10 | H8 | H9 | 118.3° | 120.0° |
| C09 | C10 | C11 | H10 | 167.6° | 60.0° |
| C09 | C10 | C11 | H11 | 48.2° | 60.1° |
| C18 | C19 | O20 | C28 | 180.0° | 180.0° |
| C18 | C19 | C28 | C29 | 0.1° | 0.3° |
| C19 | C18 | C17 | H16 | 179.9° | 179.9° |
| C18 | C19 | C28 | H31 | 180.0° | 180.0° |
| C16 | C29 | C28 | C19 | 0.1° | 0.6° |
| C16 | C29 | C28 | H32 | 180.0° | 179.7° |
| C29 | C16 | N15 | H15 | 128.2° | 144.8° |
| C29 | C16 | C17 | H16 | 179.8° | 179.8° |
| C16 | C29 | C28 | H31 | 179.9° | 179.7° |
| O20 | C19 | C28 | C29 | 180.0° | 179.8° |
| O20 | C19 | C18 | H17 | 0.0° | 0.0° |
| C19 | O20 | C21 | H18 | 56.4° | 35.9° |
| O20 | C19 | C28 | H31 | 0.0° | 0.0° |
| C19 | C28 | C29 | H31 | 180.0° | 179.7° |
| C28 | C19 | C18 | H17 | 179.9° | 180.0° |
| C19 | C28 | C29 | H32 | 179.9° | 179.7° |
| C38 | C36 | C01 | C02 | 68.6° | 173.0° |
| C38 | C36 | C01 | C37 | 119.3° | 119.4° |
| C38 | C36 | C01 | C35 | 117.5° | 120.3° |
| C38 | C36 | C37 | C35 | 118.4° | 119.4° |
| C38 | C36 | C35 | C33 | 71.2° | 174.7° |
| C38 | C36 | C01 | H1 | 52.0° | 53.2° |
| C38 | C36 | C01 | H2 | 170.8° | 67.0° |
| C38 | C36 | C35 | H36 | 49.6° | 55.0° |
| C38 | C36 | C35 | H37 | 167.9° | 65.6° |
| C38 | C36 | C37 | H38 | 180.0° | 179.4° |
| C38 | C36 | C37 | H39 | 60.0° | 60.6° |
| C38 | C36 | C37 | H40 | 60.0° | 59.4° |
| C36 | C38 | H41 | H42 | 120.0° | 120.0° |
| C36 | C38 | H41 | H43 | 120.0° | 120.0° |
| C36 | C38 | H42 | H43 | 120.0° | 120.0° |
| C09 | C08 | C13 | N07 | 124.9° | 120.0° |
| C09 | C08 | C13 | H5 | 116.8° | 120.0° |
| C09 | C08 | N07 | H5 | 117.3° | 120.0° |
| C09 | C08 | N07 | C05 | 168.2° | 85.0° |
| C09 | C08 | C13 | O14 | 99.5° | 120.0° |
| C09 | C08 | N07 | H4 | 11.8° | 95.0° |
| C08 | C09 | H6 | H7 | 119.5° | 120.0° |
| C08 | C09 | C10 | H8 | 168.6° | 60.0° |
| C08 | C09 | C10 | H9 | 49.8° | 60.0° |
| C13 | C08 | N07 | H5 | 117.4° | 120.1° |
| C13 | C08 | N07 | C05 | 66.5° | 155.0° |
| C13 | C08 | N07 | H4 | 113.5° | 25.0° |
| C13 | C08 | C09 | H6 | 40.4° | 65.0° |
| C13 | C08 | C09 | H7 | 79.3° | 55.0° |
| C08 | C13 | N15 | H15 | 1.4° | 4.2° |
| C08 | N07 | C05 | H4 | 180.0° | 180.0° |
| C08 | N07 | C05 | C04 | 177.5° | 180.0° |
| N07 | C08 | C13 | O14 | 25.4° | 0.0° |
| N07 | C08 | C09 | H6 | 166.5° | 55.0° |
| N07 | C08 | C09 | H7 | 46.8° | 175.0° |
| N07 | C05 | C04 | N03 | 175.9° | 0.1° |
| N07 | C05 | C04 | C30 | 7.5° | 180.0° |
| C05 | N07 | C08 | H5 | 50.9° | 34.9° |
| C05 | C04 | N03 | C30 | 177.2° | 180.0° |
| C05 | C04 | N03 | C02 | 179.0° | 179.9° |
| C05 | C04 | C30 | C32 | 178.4° | 179.9° |
| C05 | C04 | C30 | C31 | 1.7° | 0.1° |
| C05 | C04 | N03 | H3 | 1.0° | 0.0° |
| C04 | C05 | N07 | H4 | 2.5° | 0.0° |
| O14 | C13 | C08 | H5 | 143.7° | 120.0° |
| O14 | C13 | N15 | H15 | 178.8° | 175.8° |
| C04 | N03 | C02 | H3 | 180.0° | 180.0° |
| C04 | N03 | C02 | C01 | 179.3° | 179.8° |
| C04 | N03 | C02 | C32 | 1.3° | 0.2° |
| N03 | C04 | C30 | C32 | 1.4° | 0.0° |
| N03 | C04 | C30 | C31 | 178.6° | 180.0° |
| C02 | N03 | C04 | C30 | 1.7° | 0.1° |
| N03 | C02 | C01 | C32 | 179.3° | 180.0° |
| N03 | C02 | C01 | C36 | 151.8° | 159.6° |
| N03 | C02 | C32 | C30 | 0.4° | 0.2° |
| N03 | C02 | C32 | C33 | 179.3° | 179.7° |
| N03 | C02 | C01 | H1 | 31.2° | 80.5° |
| N03 | C02 | C01 | H2 | 87.6° | 39.6° |
| C04 | C30 | C32 | C02 | 0.6° | 0.1° |
| C04 | C30 | C32 | C31 | 180.0° | 180.0° |
| C04 | C30 | C32 | C33 | 179.7° | 179.8° |
| C30 | C04 | N03 | H3 | 178.3° | 179.9° |
| C04 | C30 | C31 | H33 | 90.0° | 89.9° |
| C04 | C30 | C31 | H34 | 150.0° | 150.0° |
| C04 | C30 | C31 | H35 | 30.0° | 30.0° |
| C02 | C01 | C36 | H1 | 120.6° | 119.9° |
| C02 | C01 | C36 | H2 | 120.6° | 119.9° |
| C02 | C01 | C36 | C37 | 172.1° | 67.6° |
| C02 | C01 | C36 | C35 | 48.9° | 52.7° |
| C01 | C02 | C32 | C30 | 179.9° | 179.8° |
| C01 | C02 | C32 | C33 | 0.1° | 0.3° |
| C02 | C01 | H1 | H2 | 118.2° | 120.1° |
| C01 | C02 | N03 | H3 | 0.7° | 0.2° |
| C36 | C01 | C02 | C32 | 27.5° | 20.4° |
| C01 | C36 | C37 | C35 | 122.0° | 121.3° |
| C01 | C36 | C35 | C33 | 46.7° | 65.0° |
| C36 | C01 | H1 | H2 | 118.2° | 120.2° |
| C01 | C36 | C35 | H36 | 167.5° | 175.3° |
| C01 | C36 | C35 | H37 | 74.2° | 54.7° |
| C01 | C36 | C37 | H38 | 60.4° | 60.0° |
| C01 | C36 | C37 | H39 | 179.6° | 179.9° |
| C01 | C36 | C37 | H40 | 59.6° | 59.9° |
| C01 | C36 | C38 | H41 | 180.0° | 60.0° |
| C01 | C36 | C38 | H42 | 60.0° | 180.0° |
| C01 | C36 | C38 | H43 | 60.0° | 60.0° |
| C02 | C32 | C30 | C33 | 179.7° | 179.9° |
| C02 | C32 | C30 | C31 | 179.4° | 179.9° |
| C02 | C32 | C33 | C35 | 2.9° | 11.4° |
| C02 | C32 | C33 | O34 | 177.3° | 168.7° |
| C32 | C02 | C01 | H1 | 148.1° | 99.5° |
| C32 | C02 | C01 | H2 | 93.1° | 140.4° |
| C32 | C02 | N03 | H3 | 178.7° | 179.9° |
| C37 | C36 | C35 | C33 | 170.3° | 55.4° |
| C37 | C36 | C01 | H1 | 67.3° | 172.5° |
| C37 | C36 | C01 | H2 | 51.5° | 52.3° |
| C37 | C36 | C35 | H36 | 68.9° | 64.4° |
| C37 | C36 | C35 | H37 | 49.5° | 175.1° |
| C36 | C37 | H38 | H39 | 120.0° | 120.0° |
| C36 | C37 | H38 | H40 | 120.0° | 120.0° |
| C36 | C37 | H39 | H40 | 120.0° | 120.0° |
| C37 | C36 | C38 | H41 | 58.4° | 59.4° |
| C37 | C36 | C38 | H42 | 178.4° | 60.6° |
| C37 | C36 | C38 | H43 | 61.6° | 179.4° |
| C36 | C35 | C33 | C32 | 22.1° | 42.7° |
| C36 | C35 | C33 | H36 | 120.8° | 119.8° |
| C36 | C35 | C33 | H37 | 120.8° | 119.7° |
| C36 | C35 | C33 | O34 | 157.7° | 137.4° |
| C35 | C36 | C01 | H1 | 169.5° | 67.1° |
| C35 | C36 | C01 | H2 | 71.7° | 172.7° |
| C36 | C35 | H36 | H37 | 117.4° | 120.6° |
| C35 | C36 | C37 | H38 | 61.6° | 61.2° |
| C35 | C36 | C37 | H39 | 58.4° | 58.8° |
| C35 | C36 | C37 | H40 | 178.4° | 178.8° |
| C35 | C36 | C38 | H41 | 61.9° | 178.8° |
| C35 | C36 | C38 | H42 | 58.1° | 58.8° |
| C35 | C36 | C38 | H43 | 178.1° | 61.2° |
| C30 | C32 | C33 | C35 | 176.8° | 168.5° |
| C30 | C32 | C33 | O34 | 3.0° | 11.5° |
| C32 | C30 | C31 | H33 | 90.0° | 90.1° |
| C32 | C30 | C31 | H34 | 30.0° | 30.0° |
| C32 | C30 | C31 | H35 | 150.0° | 150.0° |
| C31 | C30 | C32 | C33 | 0.3° | 0.2° |
| C30 | C31 | H33 | H34 | 120.0° | 120.1° |
| C30 | C31 | H33 | H35 | 120.0° | 120.0° |
| C30 | C31 | H34 | H35 | 120.0° | 120.0° |
| C32 | C33 | C35 | O34 | 179.8° | 179.9° |
| C32 | C33 | C35 | H36 | 142.9° | 162.5° |
| C32 | C33 | C35 | H37 | 98.8° | 77.0° |
| C33 | C35 | H36 | H37 | 117.5° | 120.5° |
| O34 | C33 | C35 | H36 | 36.9° | 17.6° |
| O34 | C33 | C35 | H37 | 81.5° | 102.9° |
| H4 | N07 | C08 | H5 | 129.1° | 145.0° |
| H5 | C08 | C09 | H6 | 75.8° | 174.9° |
| H5 | C08 | C09 | H7 | 164.5° | 65.0° |
| H6 | C09 | C10 | H8 | 71.2° | 180.0° |
| H6 | C09 | C10 | H9 | 169.9° | 60.0° |
| H7 | C09 | C10 | H8 | 48.5° | 60.0° |
| H7 | C09 | C10 | H9 | 70.4° | 179.9° |
| H8 | C10 | C11 | H10 | 71.8° | 180.0° |
| H8 | C10 | C11 | H11 | 168.8° | 60.0° |
| H9 | C10 | C11 | H10 | 47.0° | 60.0° |
| H9 | C10 | C11 | H11 | 72.3° | 180.0° |
| H10 | C11 | C12 | H12 | 59.7° | 180.0° |
| H10 | C11 | C12 | H13 | 60.3° | 60.0° |
| H10 | C11 | C12 | H14 | 179.7° | 60.0° |
| H11 | C11 | C12 | H12 | 59.7° | 59.9° |
| H11 | C11 | C12 | H13 | 179.7° | 179.9° |
| H11 | C11 | C12 | H14 | 60.3° | 60.1° |
| H12 | C12 | H13 | H14 | 120.0° | 120.0° |
| H16 | C17 | C18 | H17 | 0.2° | 0.0° |
| H18 | C21 | C22 | H19 | 61.2° | 57.7° |
| H18 | C21 | C22 | H20 | 58.7° | 177.8° |
| H18 | C21 | C27 | H29 | 60.0° | 177.7° |
| H18 | C21 | C27 | H30 | 60.0° | 57.6° |
| H19 | C22 | C23 | H21 | 58.3° | 59.1° |
| H19 | C22 | C23 | H22 | 60.5° | 60.9° |
| H20 | C22 | C23 | H21 | 61.5° | 179.2° |
| H20 | C22 | C23 | H22 | 179.7° | 59.2° |
| H24 | C25 | H25 | H26 | 120.0° | 120.0° |
| H27 | C26 | C27 | H29 | 55.5° | 179.2° |
| H27 | C26 | C27 | H30 | 64.6° | 59.1° |
| H28 | C26 | C27 | H29 | 63.5° | 59.2° |
| H28 | C26 | C27 | H30 | 176.5° | 60.9° |
| H31 | C28 | C29 | H32 | 0.1° | 0.0° |
| H33 | C31 | H34 | H35 | 120.0° | 119.9° |
| H38 | C37 | H39 | H40 | 120.0° | 120.0° |
| H41 | C38 | H42 | H43 | 120.0° | 120.0° |
