L4X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.40Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C32 | C31 | doub | 1.38Å | 1.40Å | Aromatic |
| C32 | C33 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
| C36 | C33 | sing | 1.51Å | 1.50Å | |
| C31 | C30 | sing | 1.38Å | 1.40Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| C33 | C34 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C38 | N37 | sing | 1.47Å | 1.47Å | |
| C16 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | C27 | sing | 1.39Å | 1.40Å | Aromatic |
| C22 | C21 | sing | 1.48Å | 1.49Å | |
| C30 | C29 | sing | 1.51Å | 1.52Å | |
| C30 | C35 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C34 | C35 | sing | 1.38Å | 1.40Å | Aromatic |
| C29 | C03 | sing | 1.53Å | 1.56Å | |
| O28 | C05 | doub | 1.21Å | 1.23Å | |
| C21 | C20 | doub | 1.33Å | 1.34Å | |
| C03 | C02 | sing | 1.51Å | 1.57Å | |
| C03 | N04 | sing | 1.46Å | 1.48Å | |
| C17 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| N37 | C02 | sing | 1.35Å | 1.40Å | |
| C13 | C12 | sing | 1.38Å | 1.40Å | Aromatic |
| C20 | C19 | sing | 1.51Å | 1.51Å | |
| C05 | N04 | sing | 1.35Å | 1.41Å | |
| C05 | C06 | sing | 1.51Å | 1.57Å | |
| C02 | O01 | doub | 1.21Å | 1.23Å | |
| C12 | C11 | sing | 1.51Å | 1.52Å | |
| C19 | C06 | sing | 1.53Å | 1.58Å | |
| N07 | C06 | sing | 1.47Å | 1.45Å | |
| N07 | C08 | sing | 1.35Å | 1.42Å | |
| C11 | N10 | sing | 1.47Å | 1.49Å | |
| C09 | C08 | sing | 1.51Å | 1.55Å | |
| C09 | N10 | sing | 1.47Å | 1.48Å | |
| C08 | O18 | doub | 1.21Å | 1.22Å | |
| C11 | H1 | sing | 1.09Å | 1.10Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H3 | sing | 1.08Å | 1.08Å | |
| C14 | H4 | sing | 1.08Å | 1.08Å | |
| C15 | H5 | sing | 1.08Å | 1.08Å | |
| C16 | H6 | sing | 1.08Å | 1.08Å | |
| C17 | H7 | sing | 1.08Å | 1.08Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.08Å | 1.08Å | |
| C23 | H11 | sing | 1.08Å | 1.08Å | |
| C24 | H12 | sing | 1.08Å | 1.08Å | |
| C25 | H13 | sing | 1.08Å | 1.08Å | |
| C26 | H14 | sing | 1.08Å | 1.08Å | |
| C27 | H15 | sing | 1.08Å | 1.08Å | |
| C29 | H16 | sing | 1.09Å | 1.10Å | |
| C29 | H17 | sing | 1.09Å | 1.10Å | |
| C31 | H18 | sing | 1.08Å | 1.08Å | |
| C32 | H19 | sing | 1.08Å | 1.08Å | |
| C03 | H20 | sing | 1.09Å | 1.10Å | |
| C06 | H21 | sing | 1.09Å | 1.10Å | |
| C09 | H22 | sing | 1.09Å | 1.10Å | |
| C09 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.08Å | 1.08Å | |
| C34 | H25 | sing | 1.08Å | 1.08Å | |
| C35 | H26 | sing | 1.08Å | 1.08Å | |
| C36 | H27 | sing | 1.09Å | 1.10Å | |
| C36 | H28 | sing | 1.09Å | 1.10Å | |
| C36 | H29 | sing | 1.09Å | 1.10Å | |
| C38 | H30 | sing | 1.09Å | 1.10Å | |
| C38 | H31 | sing | 1.09Å | 1.10Å | |
| C38 | H32 | sing | 1.09Å | 1.10Å | |
| N04 | H33 | sing | 0.97Å | 1.00Å | |
| N07 | H34 | sing | 0.97Å | 1.00Å | |
| N10 | H35 | sing | 1.01Å | 1.00Å | |
| N37 | H37 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C24 | C23 | 120.8° | 120.1° |
| C24 | C25 | C26 | 118.3° | 120.3° |
| C25 | C24 | H12 | 119.6° | 119.9° |
| C24 | C25 | H13 | 120.9° | 119.8° |
| C24 | C23 | C22 | 121.9° | 119.9° |
| C24 | C23 | H11 | 119.1° | 120.0° |
| C23 | C24 | H12 | 119.6° | 120.0° |
| C25 | C26 | C27 | 120.7° | 120.1° |
| C26 | C25 | H13 | 120.8° | 119.9° |
| C25 | C26 | H14 | 119.7° | 119.9° |
| C31 | C32 | C33 | 121.9° | 120.0° |
| C32 | C31 | C30 | 122.3° | 120.0° |
| C32 | C31 | H18 | 118.9° | 120.0° |
| C31 | C32 | H19 | 119.1° | 120.0° |
| C32 | C33 | C36 | 121.9° | 120.0° |
| C32 | C33 | C34 | 116.3° | 120.0° |
| C33 | C32 | H19 | 119.0° | 120.0° |
| C23 | C22 | C27 | 116.3° | 119.8° |
| C23 | C22 | C21 | 122.1° | 120.1° |
| C22 | C23 | H11 | 119.0° | 120.1° |
| C36 | C33 | C34 | 121.9° | 120.0° |
| C33 | C36 | H27 | 109.5° | 109.5° |
| C33 | C36 | H28 | 109.5° | 109.5° |
| C33 | C36 | H29 | 109.5° | 109.5° |
| C31 | C30 | C29 | 121.6° | 120.0° |
| C31 | C30 | C35 | 115.5° | 120.0° |
| C30 | C31 | H18 | 118.9° | 120.0° |
| C26 | C27 | C22 | 122.0° | 119.8° |
| C27 | C26 | H14 | 119.7° | 119.9° |
| C26 | C27 | H15 | 119.0° | 120.0° |
| C33 | C34 | C35 | 121.7° | 120.0° |
| C33 | C34 | H25 | 119.2° | 120.0° |
| C16 | C15 | C14 | 118.6° | 120.0° |
| C15 | C16 | C17 | 120.5° | 120.0° |
| C16 | C15 | H5 | 120.7° | 120.0° |
| C15 | C16 | H6 | 119.7° | 120.0° |
| C15 | C14 | C13 | 120.8° | 120.0° |
| C15 | C14 | H4 | 119.6° | 120.0° |
| C14 | C15 | H5 | 120.7° | 120.0° |
| C38 | N37 | C02 | 123.8° | 120.0° |
| N37 | C38 | H30 | 109.5° | 109.4° |
| N37 | C38 | H31 | 109.5° | 109.5° |
| N37 | C38 | H32 | 109.5° | 109.5° |
| C38 | N37 | H37 | 118.1° | 120.0° |
| C16 | C17 | C12 | 121.6° | 120.0° |
| C17 | C16 | H6 | 119.7° | 120.0° |
| C16 | C17 | H7 | 119.2° | 120.0° |
| C27 | C22 | C21 | 121.6° | 120.1° |
| C22 | C27 | H15 | 119.0° | 120.1° |
| C22 | C21 | C20 | 126.3° | 120.0° |
| C22 | C21 | H10 | 116.9° | 120.0° |
| C29 | C30 | C35 | 122.9° | 120.0° |
| C30 | C29 | C03 | 115.3° | 109.5° |
| C30 | C29 | H16 | 108.0° | 109.5° |
| C30 | C29 | H17 | 108.0° | 109.4° |
| C30 | C35 | C34 | 122.4° | 120.0° |
| C30 | C35 | H26 | 118.8° | 120.0° |
| C14 | C13 | C12 | 121.1° | 120.0° |
| C14 | C13 | H3 | 119.5° | 120.0° |
| C13 | C14 | H4 | 119.6° | 120.0° |
| C35 | C34 | H25 | 119.1° | 120.0° |
| C34 | C35 | H26 | 118.8° | 120.0° |
| C29 | C03 | C02 | 112.8° | 109.5° |
| C29 | C03 | N04 | 113.5° | 109.5° |
| C03 | C29 | H16 | 108.0° | 109.5° |
| C03 | C29 | H17 | 108.0° | 109.5° |
| C29 | C03 | H20 | 107.1° | 109.5° |
| O28 | C05 | N04 | 119.9° | 120.0° |
| O28 | C05 | C06 | 119.5° | 120.0° |
| C21 | C20 | C19 | 127.5° | 120.0° |
| C20 | C21 | H10 | 116.8° | 120.0° |
| C21 | C20 | H24 | 116.2° | 120.0° |
| C02 | C03 | N04 | 108.1° | 109.5° |
| C03 | C02 | N37 | 120.2° | 120.0° |
| C03 | C02 | O01 | 121.0° | 120.0° |
| C02 | C03 | H20 | 107.0° | 109.5° |
| C03 | N04 | C05 | 124.8° | 120.0° |
| N04 | C03 | H20 | 108.0° | 109.5° |
| C03 | N04 | H33 | 117.6° | 120.0° |
| C17 | C12 | C13 | 117.3° | 120.0° |
| C17 | C12 | C11 | 122.0° | 120.0° |
| C12 | C17 | H7 | 119.2° | 119.9° |
| N37 | C02 | O01 | 118.8° | 120.0° |
| C02 | N37 | H37 | 118.1° | 120.0° |
| C13 | C12 | C11 | 120.6° | 120.0° |
| C12 | C13 | H3 | 119.4° | 120.0° |
| C20 | C19 | C06 | 115.4° | 109.5° |
| C20 | C19 | H8 | 107.9° | 109.5° |
| C20 | C19 | H9 | 107.9° | 109.5° |
| C19 | C20 | H24 | 116.2° | 120.0° |
| N04 | C05 | C06 | 120.6° | 120.0° |
| C05 | N04 | H33 | 117.6° | 120.0° |
| C05 | C06 | C19 | 110.2° | 109.5° |
| C05 | C06 | N07 | 114.2° | 109.5° |
| C05 | C06 | H21 | 106.5° | 109.5° |
| C12 | C11 | N10 | 116.4° | 109.5° |
| C12 | C11 | H1 | 107.7° | 109.5° |
| C12 | C11 | H2 | 107.7° | 109.4° |
| C19 | C06 | N07 | 111.3° | 109.4° |
| C06 | C19 | H8 | 108.0° | 109.4° |
| C06 | C19 | H9 | 108.0° | 109.5° |
| C19 | C06 | H21 | 106.4° | 109.5° |
| C06 | N07 | C08 | 124.8° | 120.0° |
| N07 | C06 | H21 | 107.8° | 109.4° |
| C06 | N07 | H34 | 117.6° | 120.0° |
| N07 | C08 | C09 | 120.3° | 120.0° |
| N07 | C08 | O18 | 120.3° | 120.1° |
| C08 | N07 | H34 | 117.6° | 120.0° |
| C11 | N10 | C09 | 116.0° | 111.0° |
| N10 | C11 | H1 | 107.7° | 109.5° |
| N10 | C11 | H2 | 107.7° | 109.5° |
| C11 | N10 | H35 | 107.8° | 111.0° |
| C08 | C09 | N10 | 111.9° | 109.5° |
| C09 | C08 | O18 | 119.4° | 119.9° |
| C08 | C09 | H22 | 108.9° | 109.5° |
| C08 | C09 | H23 | 108.9° | 109.5° |
| N10 | C09 | H22 | 108.8° | 109.5° |
| N10 | C09 | H23 | 108.9° | 109.5° |
| C09 | N10 | H35 | 107.8° | 111.0° |
| H1 | C11 | H2 | 109.5° | 109.5° |
| H8 | C19 | H9 | 109.5° | 109.5° |
| H16 | C29 | H17 | 109.5° | 109.5° |
| H22 | C09 | H23 | 109.5° | 109.4° |
| H27 | C36 | H28 | 109.5° | 109.4° |
| H27 | C36 | H29 | 109.4° | 109.5° |
| H28 | C36 | H29 | 109.5° | 109.5° |
| H30 | C38 | H31 | 109.4° | 109.5° |
| H30 | C38 | H32 | 109.5° | 109.5° |
| H31 | C38 | H32 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C24 | C23 | H12 | 180.0° | 180.0° |
| C24 | C25 | C26 | H13 | 180.0° | 180.0° |
| C25 | C24 | C23 | C22 | 0.1° | 0.0° |
| C24 | C25 | C26 | C27 | 0.1° | 0.1° |
| C25 | C24 | C23 | H11 | 179.9° | 180.0° |
| C24 | C25 | C26 | H14 | 180.0° | 179.9° |
| C23 | C24 | C25 | C26 | 0.0° | 0.0° |
| C24 | C23 | C22 | H11 | 180.0° | 180.0° |
| C24 | C23 | C22 | C27 | 0.1° | 0.0° |
| C24 | C23 | C22 | C21 | 180.0° | 179.7° |
| C23 | C24 | C25 | H13 | 180.0° | 180.0° |
| C25 | C26 | C27 | H14 | 180.0° | 179.9° |
| C25 | C26 | C27 | C22 | 0.1° | 0.1° |
| C26 | C25 | C24 | H12 | 180.0° | 180.0° |
| C25 | C26 | C27 | H15 | 179.9° | 179.7° |
| C31 | C32 | C33 | H19 | 180.0° | 179.9° |
| C31 | C32 | C33 | C36 | 180.0° | 179.9° |
| C32 | C31 | C30 | H18 | 180.0° | 179.6° |
| C31 | C32 | C33 | C34 | 0.0° | 0.1° |
| C32 | C31 | C30 | C29 | 179.8° | 179.7° |
| C32 | C31 | C30 | C35 | 0.3° | 0.3° |
| C32 | C33 | C36 | C34 | 180.0° | 180.0° |
| C33 | C32 | C31 | C30 | 0.2° | 0.1° |
| C32 | C33 | C34 | C35 | 0.0° | 0.3° |
| C33 | C32 | C31 | H18 | 179.8° | 179.7° |
| C32 | C33 | C34 | H25 | 180.0° | 180.0° |
| C32 | C33 | C36 | H27 | 90.0° | 90.0° |
| C32 | C33 | C36 | H28 | 150.0° | 150.1° |
| C32 | C33 | C36 | H29 | 30.0° | 30.0° |
| C23 | C22 | C27 | C26 | 0.0° | 0.1° |
| C23 | C22 | C27 | C21 | 179.9° | 179.8° |
| C23 | C22 | C21 | C20 | 47.0° | 0.3° |
| C23 | C22 | C21 | H10 | 132.9° | 179.7° |
| C22 | C23 | C24 | H12 | 179.9° | 180.0° |
| C23 | C22 | C27 | H15 | 180.0° | 179.7° |
| C36 | C33 | C34 | C35 | 180.0° | 179.7° |
| C36 | C33 | C32 | H19 | 0.0° | 0.0° |
| C36 | C33 | C34 | H25 | 0.0° | 0.0° |
| C33 | C36 | H27 | H28 | 120.0° | 120.0° |
| C33 | C36 | H27 | H29 | 120.0° | 120.0° |
| C33 | C36 | H28 | H29 | 120.0° | 120.1° |
| C31 | C30 | C29 | C35 | 179.4° | 180.0° |
| C31 | C30 | C35 | C34 | 0.3° | 0.6° |
| C31 | C30 | C29 | C03 | 85.4° | 90.0° |
| C31 | C30 | C29 | H16 | 35.5° | 30.0° |
| C31 | C30 | C29 | H17 | 153.8° | 150.0° |
| C30 | C31 | C32 | H19 | 179.8° | 180.0° |
| C31 | C30 | C35 | H26 | 179.7° | 180.0° |
| C26 | C27 | C22 | H15 | 180.0° | 179.6° |
| C26 | C27 | C22 | C21 | 179.9° | 179.7° |
| C27 | C26 | C25 | H13 | 179.9° | 179.9° |
| C33 | C34 | C35 | C30 | 0.2° | 0.6° |
| C33 | C34 | C35 | H25 | 180.0° | 179.7° |
| C34 | C33 | C32 | H19 | 180.0° | 180.0° |
| C33 | C34 | C35 | H26 | 179.9° | 180.0° |
| C34 | C33 | C36 | H27 | 90.0° | 90.0° |
| C34 | C33 | C36 | H28 | 30.0° | 29.9° |
| C34 | C33 | C36 | H29 | 150.0° | 150.0° |
| C16 | C15 | C14 | H5 | 180.0° | 179.7° |
| C15 | C16 | C17 | H6 | 180.0° | 179.7° |
| C16 | C15 | C14 | C13 | 0.0° | 0.0° |
| C15 | C16 | C17 | C12 | 0.2° | 0.6° |
| C16 | C15 | C14 | H4 | 180.0° | 180.0° |
| C15 | C16 | C17 | H7 | 179.8° | 180.0° |
| C14 | C15 | C16 | C17 | 0.1° | 0.3° |
| C15 | C14 | C13 | H4 | 180.0° | 180.0° |
| C15 | C14 | C13 | C12 | 0.0° | 0.1° |
| C15 | C14 | C13 | H3 | 180.0° | 179.9° |
| C14 | C15 | C16 | H6 | 179.9° | 180.0° |
| C38 | N37 | C02 | C03 | 0.0° | 180.0° |
| C38 | N37 | C02 | H37 | 180.0° | 180.0° |
| C38 | N37 | C02 | O01 | 180.0° | 0.0° |
| N37 | C38 | H30 | H31 | 120.0° | 120.0° |
| N37 | C38 | H30 | H32 | 120.0° | 120.0° |
| N37 | C38 | H31 | H32 | 120.0° | 120.0° |
| C16 | C17 | C12 | H7 | 180.0° | 179.4° |
| C16 | C17 | C12 | C13 | 0.3° | 0.6° |
| C16 | C17 | C12 | C11 | 180.0° | 179.7° |
| C17 | C16 | C15 | H5 | 179.9° | 180.0° |
| C27 | C22 | C21 | C20 | 133.1° | 180.0° |
| C27 | C22 | C21 | H10 | 46.9° | 0.0° |
| C27 | C22 | C23 | H11 | 179.9° | 180.0° |
| C22 | C27 | C26 | H14 | 180.0° | 180.0° |
| C22 | C21 | C20 | H10 | 180.0° | 180.0° |
| C22 | C21 | C20 | C19 | 180.0° | 180.0° |
| C21 | C22 | C23 | H11 | 0.0° | 0.2° |
| C21 | C22 | C27 | H15 | 0.1° | 0.1° |
| C22 | C21 | C20 | H24 | 0.0° | 0.0° |
| C29 | C30 | C35 | C34 | 179.8° | 179.5° |
| C30 | C29 | C03 | H16 | 120.8° | 120.1° |
| C30 | C29 | C03 | H17 | 120.9° | 120.0° |
| C30 | C29 | C03 | C02 | 166.2° | 175.0° |
| C30 | C29 | C03 | N04 | 42.8° | 65.0° |
| C30 | C29 | H16 | H17 | 117.3° | 120.0° |
| C29 | C30 | C31 | H18 | 0.2° | 0.1° |
| C30 | C29 | C03 | H20 | 76.4° | 55.0° |
| C29 | C30 | C35 | H26 | 0.3° | 0.0° |
| C30 | C35 | C34 | H26 | 180.0° | 179.4° |
| C35 | C30 | C29 | C03 | 94.1° | 90.0° |
| C35 | C30 | C29 | H16 | 145.1° | 150.0° |
| C35 | C30 | C29 | H17 | 26.8° | 30.0° |
| C35 | C30 | C31 | H18 | 179.7° | 179.9° |
| C30 | C35 | C34 | H25 | 179.9° | 179.7° |
| C14 | C13 | C12 | C17 | 0.2° | 0.3° |
| C14 | C13 | C12 | H3 | 180.0° | 179.9° |
| C14 | C13 | C12 | C11 | 179.9° | 179.9° |
| C13 | C14 | C15 | H5 | 180.0° | 179.7° |
| C29 | C03 | C02 | N04 | 126.3° | 120.0° |
| C29 | C03 | C02 | H20 | 117.5° | 120.0° |
| C29 | C03 | N04 | H20 | 118.6° | 120.0° |
| C29 | C03 | C02 | N37 | 88.8° | 60.0° |
| C29 | C03 | N04 | C05 | 116.6° | 155.0° |
| C29 | C03 | C02 | O01 | 91.2° | 120.0° |
| C03 | C29 | H16 | H17 | 117.3° | 120.0° |
| C29 | C03 | N04 | H33 | 63.4° | 25.0° |
| O28 | C05 | N04 | C03 | 0.4° | 0.0° |
| O28 | C05 | N04 | C06 | 179.9° | 180.0° |
| O28 | C05 | C06 | C19 | 101.1° | 119.9° |
| O28 | C05 | C06 | N07 | 25.1° | 0.0° |
| O28 | C05 | C06 | H21 | 143.9° | 120.0° |
| O28 | C05 | N04 | H33 | 179.5° | 180.0° |
| C21 | C20 | C19 | H24 | 180.0° | 180.0° |
| C21 | C20 | C19 | C06 | 170.8° | 125.0° |
| C21 | C20 | C19 | H8 | 49.9° | 5.0° |
| C21 | C20 | C19 | H9 | 68.4° | 115.0° |
| C02 | C03 | N04 | H20 | 115.5° | 120.0° |
| C03 | C02 | N37 | O01 | 180.0° | 180.0° |
| C02 | C03 | N04 | C05 | 117.5° | 85.0° |
| C02 | C03 | C29 | H16 | 73.0° | 65.0° |
| C02 | C03 | C29 | H17 | 45.3° | 55.0° |
| C02 | C03 | N04 | H33 | 62.5° | 95.0° |
| C03 | C02 | N37 | H37 | 180.0° | 0.0° |
| N04 | C03 | C02 | N37 | 144.8° | 180.0° |
| C03 | N04 | C05 | H33 | 180.0° | 180.0° |
| C03 | N04 | C05 | C06 | 179.5° | 180.0° |
| N04 | C03 | C02 | O01 | 35.2° | 0.0° |
| N04 | C03 | C29 | H16 | 163.6° | 55.0° |
| N04 | C03 | C29 | H17 | 78.1° | 175.0° |
| C17 | C12 | C13 | C11 | 179.7° | 179.7° |
| C17 | C12 | C11 | N10 | 100.7° | 90.3° |
| C17 | C12 | C11 | H1 | 20.3° | 29.8° |
| C17 | C12 | C11 | H2 | 138.3° | 149.7° |
| C17 | C12 | C13 | H3 | 179.8° | 179.8° |
| C12 | C17 | C16 | H6 | 179.8° | 179.7° |
| N37 | C02 | C03 | H20 | 28.7° | 60.0° |
| C02 | N37 | C38 | H30 | 180.0° | 60.0° |
| C02 | N37 | C38 | H31 | 60.0° | 60.0° |
| C02 | N37 | C38 | H32 | 60.0° | 180.0° |
| C13 | C12 | C11 | N10 | 79.6° | 90.0° |
| C13 | C12 | C11 | H1 | 159.4° | 150.0° |
| C13 | C12 | C11 | H2 | 41.4° | 30.0° |
| C12 | C13 | C14 | H4 | 180.0° | 179.9° |
| C13 | C12 | C17 | H7 | 179.8° | 180.0° |
| C20 | C19 | C06 | C05 | 77.0° | 175.0° |
| C20 | C19 | C06 | H8 | 120.9° | 120.0° |
| C20 | C19 | C06 | H9 | 120.8° | 120.1° |
| C20 | C19 | C06 | N07 | 50.7° | 65.0° |
| C20 | C19 | H8 | H9 | 117.3° | 120.1° |
| C19 | C20 | C21 | H10 | 0.0° | 0.0° |
| C20 | C19 | C06 | H21 | 167.9° | 54.9° |
| N04 | C05 | C06 | C19 | 78.9° | 60.0° |
| N04 | C05 | C06 | N07 | 155.0° | 180.0° |
| C05 | N04 | C03 | H20 | 2.0° | 35.0° |
| N04 | C05 | C06 | H21 | 36.1° | 60.1° |
| C05 | C06 | C19 | N07 | 127.7° | 120.0° |
| C05 | C06 | C19 | H21 | 115.1° | 120.1° |
| C05 | C06 | N07 | H21 | 118.1° | 120.0° |
| C05 | C06 | N07 | C08 | 161.2° | 155.0° |
| C05 | C06 | C19 | H8 | 43.8° | 55.0° |
| C05 | C06 | C19 | H9 | 162.1° | 65.0° |
| C06 | C05 | N04 | H33 | 0.5° | 0.0° |
| C05 | C06 | N07 | H34 | 18.8° | 25.0° |
| O01 | C02 | C03 | H20 | 151.3° | 120.0° |
| O01 | C02 | N37 | H37 | 0.0° | 180.0° |
| C12 | C11 | N10 | H1 | 121.0° | 120.0° |
| C12 | C11 | N10 | H2 | 121.0° | 120.0° |
| C12 | C11 | N10 | C09 | 46.0° | 180.0° |
| C12 | C11 | H1 | H2 | 116.8° | 120.0° |
| C11 | C12 | C13 | H3 | 0.1° | 0.1° |
| C11 | C12 | C17 | H7 | 0.0° | 0.2° |
| C12 | C11 | N10 | H35 | 166.9° | 56.0° |
| C19 | C06 | N07 | H21 | 116.4° | 120.0° |
| C19 | C06 | N07 | C08 | 73.3° | 85.0° |
| C06 | C19 | H8 | H9 | 117.3° | 120.0° |
| C06 | C19 | C20 | H24 | 9.3° | 55.0° |
| C19 | C06 | N07 | H34 | 106.7° | 95.0° |
| C06 | N07 | C08 | H34 | 180.0° | 180.0° |
| C06 | N07 | C08 | C09 | 179.8° | 180.0° |
| C06 | N07 | C08 | O18 | 0.0° | 0.0° |
| N07 | C06 | C19 | H8 | 171.5° | 175.0° |
| N07 | C06 | C19 | H9 | 70.2° | 55.0° |
| N07 | C08 | C09 | O18 | 179.8° | 180.0° |
| N07 | C08 | C09 | N10 | 142.2° | 180.0° |
| C08 | N07 | C06 | H21 | 43.1° | 35.0° |
| N07 | C08 | C09 | H22 | 21.8° | 60.0° |
| N07 | C08 | C09 | H23 | 97.4° | 60.0° |
| C11 | N10 | C09 | C08 | 71.0° | 180.0° |
| C11 | N10 | C09 | H35 | 120.9° | 124.0° |
| N10 | C11 | H1 | H2 | 116.8° | 120.0° |
| C11 | N10 | C09 | H22 | 49.4° | 60.0° |
| C11 | N10 | C09 | H23 | 168.6° | 60.0° |
| C08 | C09 | N10 | H22 | 120.4° | 120.0° |
| C08 | C09 | N10 | H23 | 120.3° | 120.0° |
| C08 | C09 | H22 | H23 | 118.9° | 120.0° |
| C09 | C08 | N07 | H34 | 0.2° | 0.0° |
| C08 | C09 | N10 | H35 | 49.9° | 56.1° |
| N10 | C09 | C08 | O18 | 37.6° | 0.0° |
| C09 | N10 | C11 | H1 | 75.1° | 60.0° |
| C09 | N10 | C11 | H2 | 166.9° | 60.0° |
| N10 | C09 | H22 | H23 | 118.9° | 120.0° |
| O18 | C08 | C09 | H22 | 157.9° | 120.0° |
| O18 | C08 | C09 | H23 | 82.8° | 120.0° |
| O18 | C08 | N07 | H34 | 180.0° | 180.0° |
| H1 | C11 | N10 | H35 | 45.8° | 176.1° |
| H2 | C11 | N10 | H35 | 72.1° | 63.9° |
| H3 | C13 | C14 | H4 | 0.0° | 0.1° |
| H4 | C14 | C15 | H5 | 0.0° | 0.3° |
| H5 | C15 | C16 | H6 | 0.1° | 0.3° |
| H6 | C16 | C17 | H7 | 0.2° | 0.3° |
| H8 | C19 | C06 | H21 | 71.2° | 65.1° |
| H8 | C19 | C20 | H24 | 130.1° | 174.9° |
| H9 | C19 | C06 | H21 | 47.1° | 175.0° |
| H9 | C19 | C20 | H24 | 111.6° | 65.0° |
| H10 | C21 | C20 | H24 | 180.0° | 180.0° |
| H11 | C23 | C24 | H12 | 0.1° | 0.0° |
| H12 | C24 | C25 | H13 | 0.0° | 0.0° |
| H13 | C25 | C26 | H14 | 0.0° | 0.1° |
| H14 | C26 | C27 | H15 | 0.0° | 0.4° |
| H16 | C29 | C03 | H20 | 44.5° | 175.0° |
| H17 | C29 | C03 | H20 | 162.7° | 65.0° |
| H18 | C31 | C32 | H19 | 0.2° | 0.4° |
| H20 | C03 | N04 | H33 | 178.0° | 145.0° |
| H21 | C06 | N07 | H34 | 136.9° | 145.0° |
| H22 | C09 | N10 | H35 | 170.3° | 64.0° |
| H23 | C09 | N10 | H35 | 70.4° | 176.1° |
| H25 | C34 | C35 | H26 | 0.1° | 0.3° |
| H27 | C36 | H28 | H29 | 119.9° | 120.0° |
| H30 | C38 | H31 | H32 | 120.0° | 120.0° |
| H30 | C38 | N37 | H37 | 0.0° | 120.0° |
| H31 | C38 | N37 | H37 | 119.9° | 120.0° |
| H32 | C38 | N37 | H37 | 120.0° | 0.0° |
