06M
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N17 | C16 | sing | 1.37Å | 1.34Å | Aromatic |
| N17 | C13 | sing | 1.37Å | 1.37Å | Aromatic |
| C16 | C15 | doub | 1.34Å | 1.39Å | Aromatic |
| C13 | N12 | doub | 1.33Å | 1.36Å | Aromatic |
| C13 | C14 | sing | 1.41Å | 1.38Å | Aromatic |
| N12 | C11 | sing | 1.32Å | 1.33Å | Aromatic |
| C35 | N36 | sing | 1.36Å | 1.37Å | Aromatic |
| C35 | C34 | doub | 1.35Å | 1.39Å | Aromatic |
| C15 | C14 | sing | 1.46Å | 1.42Å | Aromatic |
| N36 | C03 | sing | 1.38Å | 1.37Å | Aromatic |
| C14 | C09 | doub | 1.41Å | 1.42Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C34 | C04 | sing | 1.41Å | 1.39Å | Aromatic |
| C09 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
| C09 | C08 | sing | 1.48Å | 1.54Å | |
| C03 | C04 | doub | 1.40Å | 1.39Å | Aromatic |
| C03 | C02 | sing | 1.41Å | 1.56Å | |
| C04 | C05 | sing | 1.47Å | 1.53Å | |
| N07 | C08 | doub | 1.33Å | 1.32Å | Aromatic |
| N07 | C06 | sing | 1.33Å | 1.32Å | Aromatic |
| C08 | N18 | sing | 1.33Å | 1.33Å | Aromatic |
| O01 | C02 | doub | 1.22Å | 1.20Å | |
| C02 | N29 | sing | 1.34Å | 1.47Å | |
| C05 | C06 | sing | 1.48Å | 1.54Å | |
| C05 | C28 | doub | 1.36Å | 1.49Å | |
| C06 | C27 | doub | 1.40Å | 1.40Å | Aromatic |
| N18 | C19 | doub | 1.32Å | 1.32Å | Aromatic |
| N29 | C28 | sing | 1.36Å | 1.43Å | |
| N29 | C30 | sing | 1.47Å | 1.47Å | |
| C27 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.51Å | 1.54Å | |
| O24 | S21 | doub | 1.42Å | 1.47Å | |
| C30 | C31 | sing | 1.53Å | 1.55Å | |
| C23 | S21 | sing | 1.81Å | 1.81Å | |
| C31 | C32 | sing | 1.51Å | 1.55Å | |
| S21 | C20 | sing | 1.81Å | 1.84Å | |
| S21 | N22 | doub | 1.49Å | 1.53Å | |
| C20 | C25 | sing | 1.53Å | 1.53Å | |
| C20 | C26 | sing | 1.53Å | 1.52Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C32 | C33 | doub | 1.31Å | 1.33Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C15 | H2 | sing | 1.08Å | 1.08Å | |
| C26 | H3 | sing | 1.09Å | 1.10Å | |
| C26 | H4 | sing | 1.09Å | 1.10Å | |
| C28 | H5 | sing | 1.08Å | 1.08Å | |
| C11 | H6 | sing | 1.08Å | 1.08Å | |
| C16 | H7 | sing | 1.08Å | 1.08Å | |
| C23 | H8 | sing | 1.09Å | 1.10Å | |
| C23 | H9 | sing | 1.09Å | 1.10Å | |
| C23 | H10 | sing | 1.09Å | 1.10Å | |
| C25 | H11 | sing | 1.09Å | 1.10Å | |
| C25 | H12 | sing | 1.09Å | 1.10Å | |
| C27 | H13 | sing | 1.08Å | 1.08Å | |
| C30 | H14 | sing | 1.09Å | 1.10Å | |
| C30 | H15 | sing | 1.09Å | 1.10Å | |
| C31 | H16 | sing | 1.09Å | 1.10Å | |
| C31 | H17 | sing | 1.09Å | 1.10Å | |
| C32 | H18 | sing | 1.08Å | 1.08Å | |
| C33 | H19 | sing | 1.08Å | 1.08Å | |
| C33 | H20 | sing | 1.08Å | 1.08Å | |
| C34 | H21 | sing | 1.08Å | 1.08Å | |
| C35 | H22 | sing | 1.08Å | 1.08Å | |
| N17 | H23 | sing | 0.97Å | 1.00Å | |
| N22 | H24 | sing | 0.97Å | 1.00Å | |
| N36 | H26 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | N17 | C13 | 110.0° | 110.0° |
| N17 | C16 | C15 | 107.9° | 109.9° |
| N17 | C16 | H7 | 126.1° | 125.1° |
| C16 | N17 | H23 | 125.0° | 125.0° |
| N17 | C13 | N12 | 131.7° | 133.1° |
| N17 | C13 | C14 | 108.2° | 107.0° |
| C13 | N17 | H23 | 125.0° | 125.0° |
| C16 | C15 | C14 | 107.3° | 106.9° |
| C16 | C15 | H2 | 126.4° | 126.6° |
| C15 | C16 | H7 | 126.0° | 125.0° |
| N12 | C13 | C14 | 120.1° | 119.9° |
| C13 | N12 | C11 | 122.5° | 122.0° |
| C13 | C14 | C15 | 106.7° | 106.3° |
| C13 | C14 | C09 | 119.0° | 119.4° |
| N12 | C11 | C10 | 120.5° | 121.7° |
| N12 | C11 | H6 | 119.8° | 119.2° |
| N36 | C35 | C34 | 108.4° | 109.5° |
| C35 | N36 | C03 | 109.0° | 108.9° |
| N36 | C35 | H22 | 125.8° | 125.2° |
| C35 | N36 | H26 | 125.5° | 125.6° |
| C35 | C34 | C04 | 107.0° | 107.7° |
| C35 | C34 | H21 | 126.5° | 126.2° |
| C34 | C35 | H22 | 125.8° | 125.3° |
| C15 | C14 | C09 | 134.4° | 134.3° |
| C14 | C15 | H2 | 126.4° | 126.5° |
| N36 | C03 | C04 | 107.7° | 107.0° |
| N36 | C03 | C02 | 132.3° | 134.1° |
| C03 | N36 | H26 | 125.5° | 125.5° |
| C14 | C09 | C10 | 119.0° | 117.8° |
| C14 | C09 | C08 | 122.1° | 121.1° |
| C11 | C10 | C09 | 118.8° | 119.2° |
| C11 | C10 | H1 | 120.6° | 120.4° |
| C10 | C11 | H6 | 119.7° | 119.1° |
| C34 | C04 | C03 | 107.9° | 106.9° |
| C34 | C04 | C05 | 132.9° | 134.5° |
| C04 | C34 | H21 | 126.5° | 126.1° |
| C10 | C09 | C08 | 118.7° | 121.1° |
| C09 | C10 | H1 | 120.6° | 120.4° |
| C09 | C08 | N07 | 118.5° | 119.2° |
| C09 | C08 | N18 | 118.6° | 119.1° |
| C04 | C03 | C02 | 119.9° | 118.8° |
| C03 | C04 | C05 | 119.2° | 118.6° |
| C03 | C02 | O01 | 121.6° | 119.7° |
| C03 | C02 | N29 | 119.2° | 120.6° |
| C04 | C05 | C06 | 123.1° | 120.7° |
| C04 | C05 | C28 | 121.4° | 118.6° |
| C08 | N07 | C06 | 119.5° | 120.6° |
| N07 | C08 | N18 | 122.8° | 121.6° |
| N07 | C06 | C05 | 119.4° | 120.5° |
| N07 | C06 | C27 | 121.5° | 119.0° |
| C08 | N18 | C19 | 119.7° | 121.0° |
| O01 | C02 | N29 | 119.1° | 119.7° |
| C02 | N29 | C28 | 121.5° | 122.4° |
| C02 | N29 | C30 | 120.1° | 118.8° |
| C06 | C05 | C28 | 115.5° | 120.7° |
| C05 | C06 | C27 | 119.0° | 120.5° |
| C05 | C28 | N29 | 118.8° | 121.0° |
| C05 | C28 | H5 | 120.6° | 119.5° |
| C06 | C27 | C19 | 115.3° | 118.4° |
| C06 | C27 | H13 | 122.3° | 120.8° |
| N18 | C19 | C27 | 121.1° | 119.3° |
| N18 | C19 | C20 | 117.7° | 120.3° |
| C28 | N29 | C30 | 118.4° | 118.9° |
| N29 | C28 | H5 | 120.7° | 119.5° |
| N29 | C30 | C31 | 109.4° | 109.5° |
| N29 | C30 | H14 | 109.5° | 109.5° |
| N29 | C30 | H15 | 109.5° | 109.4° |
| C27 | C19 | C20 | 121.2° | 120.3° |
| C19 | C27 | H13 | 122.3° | 120.8° |
| C19 | C20 | S21 | 108.4° | 115.6° |
| C19 | C20 | C25 | 114.8° | 117.5° |
| C19 | C20 | C26 | 136.1° | 117.5° |
| O24 | S21 | C23 | 119.7° | 113.5° |
| O24 | S21 | C20 | 117.4° | 113.5° |
| O24 | S21 | N22 | 114.4° | 107.2° |
| C30 | C31 | C32 | 111.7° | 109.4° |
| C31 | C30 | H14 | 109.5° | 109.5° |
| C31 | C30 | H15 | 109.5° | 109.4° |
| C30 | C31 | H16 | 108.9° | 109.4° |
| C30 | C31 | H17 | 108.9° | 109.5° |
| C23 | S21 | C20 | 86.0° | 107.2° |
| C23 | S21 | N22 | 107.7° | 107.6° |
| S21 | C23 | H8 | 109.5° | 109.5° |
| S21 | C23 | H9 | 109.5° | 109.4° |
| S21 | C23 | H10 | 109.5° | 109.5° |
| C31 | C32 | C33 | 118.2° | 120.0° |
| C32 | C31 | H16 | 108.9° | 109.5° |
| C32 | C31 | H17 | 108.9° | 109.5° |
| C31 | C32 | H18 | 120.9° | 120.0° |
| C20 | S21 | N22 | 108.1° | 107.5° |
| S21 | C20 | C25 | 110.9° | 117.5° |
| S21 | C20 | C26 | 113.8° | 117.4° |
| S21 | N22 | H24 | 112.0° | 119.9° |
| C25 | C20 | C26 | 60.2° | 60.0° |
| C20 | C25 | C26 | 59.7° | 60.0° |
| C20 | C25 | H11 | 120.0° | 117.5° |
| C20 | C25 | H12 | 120.1° | 117.5° |
| C20 | C26 | C25 | 60.1° | 60.0° |
| C20 | C26 | H3 | 120.0° | 117.5° |
| C20 | C26 | H4 | 120.0° | 117.6° |
| C25 | C26 | H3 | 120.0° | 117.5° |
| C25 | C26 | H4 | 120.0° | 117.5° |
| C26 | C25 | H11 | 120.0° | 117.5° |
| C26 | C25 | H12 | 120.1° | 117.5° |
| C33 | C32 | H18 | 120.9° | 120.0° |
| C32 | C33 | H19 | 120.0° | 120.0° |
| C32 | C33 | H20 | 120.0° | 120.0° |
| H3 | C26 | H4 | 109.5° | 115.5° |
| H8 | C23 | H9 | 109.4° | 109.5° |
| H8 | C23 | H10 | 109.5° | 109.5° |
| H9 | C23 | H10 | 109.5° | 109.4° |
| H11 | C25 | H12 | 109.5° | 115.6° |
| H14 | C30 | H15 | 109.5° | 109.5° |
| H16 | C31 | H17 | 109.5° | 109.5° |
| H19 | C33 | H20 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | N17 | C13 | H23 | 180.0° | 179.5° |
| N17 | C16 | C15 | H7 | 180.0° | 179.7° |
| C16 | N17 | C13 | N12 | 179.6° | 179.8° |
| C16 | N17 | C13 | C14 | 0.4° | 0.5° |
| N17 | C16 | C15 | C14 | 0.3° | 0.3° |
| N17 | C16 | C15 | H2 | 179.7° | 179.8° |
| C13 | N17 | C16 | C15 | 0.4° | 0.5° |
| N17 | C13 | N12 | C14 | 179.1° | 179.7° |
| N17 | C13 | N12 | C11 | 180.0° | 180.0° |
| N17 | C13 | C14 | C15 | 0.2° | 0.3° |
| N17 | C13 | C14 | C09 | 179.4° | 179.9° |
| C13 | N17 | C16 | H7 | 179.6° | 179.8° |
| C16 | C15 | C14 | C13 | 0.0° | 0.0° |
| C16 | C15 | C14 | H2 | 180.0° | 180.0° |
| C16 | C15 | C14 | C09 | 179.0° | 179.6° |
| C15 | C16 | N17 | H23 | 179.6° | 179.9° |
| N12 | C13 | C14 | C15 | 179.5° | 180.0° |
| N12 | C13 | C14 | C09 | 1.3° | 0.3° |
| C13 | N12 | C11 | C10 | 1.2° | 0.0° |
| C13 | N12 | C11 | H6 | 178.8° | 179.9° |
| N12 | C13 | N17 | H23 | 0.4° | 0.4° |
| C14 | C13 | N12 | C11 | 0.9° | 0.3° |
| C13 | C14 | C15 | C09 | 179.0° | 179.6° |
| C13 | C14 | C09 | C10 | 2.0° | 0.0° |
| C13 | C14 | C09 | C08 | 178.4° | 180.0° |
| C13 | C14 | C15 | H2 | 180.0° | 180.0° |
| C14 | C13 | N17 | H23 | 179.6° | 179.9° |
| N12 | C11 | C10 | H6 | 180.0° | 179.9° |
| N12 | C11 | C10 | C09 | 1.9° | 0.3° |
| N12 | C11 | C10 | H1 | 178.1° | 179.9° |
| N36 | C35 | C34 | H22 | 180.0° | 179.6° |
| C35 | N36 | C03 | H26 | 180.0° | 179.7° |
| N36 | C35 | C34 | C04 | 0.2° | 0.2° |
| C35 | N36 | C03 | C04 | 0.2° | 0.3° |
| C35 | N36 | C03 | C02 | 178.8° | 179.8° |
| N36 | C35 | C34 | H21 | 179.8° | 179.7° |
| C34 | C35 | N36 | C03 | 0.2° | 0.3° |
| C35 | C34 | C04 | H21 | 180.0° | 179.9° |
| C35 | C34 | C04 | C03 | 0.1° | 0.0° |
| C35 | C34 | C04 | C05 | 179.4° | 179.7° |
| C34 | C35 | N36 | H26 | 179.8° | 180.0° |
| C15 | C14 | C09 | C10 | 179.1° | 179.5° |
| C15 | C14 | C09 | C08 | 2.7° | 0.5° |
| C14 | C15 | C16 | H7 | 179.7° | 180.0° |
| N36 | C03 | C04 | C34 | 0.1° | 0.2° |
| N36 | C03 | C04 | C02 | 179.2° | 179.8° |
| N36 | C03 | C04 | C05 | 179.3° | 179.9° |
| N36 | C03 | C02 | O01 | 0.0° | 0.1° |
| N36 | C03 | C02 | N29 | 179.3° | 180.0° |
| C03 | N36 | C35 | H22 | 179.8° | 180.0° |
| C14 | C09 | C10 | C11 | 2.2° | 0.3° |
| C14 | C09 | C10 | C08 | 176.6° | 180.0° |
| C14 | C09 | C08 | N07 | 26.3° | 133.6° |
| C14 | C09 | C08 | N18 | 156.0° | 46.2° |
| C14 | C09 | C10 | H1 | 177.8° | 179.9° |
| C09 | C14 | C15 | H2 | 1.0° | 0.4° |
| C11 | C10 | C09 | H1 | 180.0° | 179.6° |
| C11 | C10 | C09 | C08 | 178.8° | 179.7° |
| C34 | C04 | C03 | C05 | 179.4° | 179.7° |
| C34 | C04 | C03 | C02 | 179.1° | 179.9° |
| C34 | C04 | C05 | C06 | 1.4° | 0.4° |
| C34 | C04 | C05 | C28 | 179.5° | 179.6° |
| C04 | C34 | C35 | H22 | 179.8° | 179.8° |
| C10 | C09 | C08 | N07 | 150.1° | 46.5° |
| C10 | C09 | C08 | N18 | 27.6° | 133.8° |
| C09 | C10 | C11 | H6 | 178.1° | 179.8° |
| C09 | C08 | N07 | N18 | 177.6° | 179.8° |
| C09 | C08 | N07 | C06 | 178.3° | 179.7° |
| C09 | C08 | N18 | C19 | 177.7° | 180.0° |
| C08 | C09 | C10 | H1 | 1.2° | 0.1° |
| C04 | C03 | C02 | O01 | 178.9° | 179.7° |
| C04 | C03 | C02 | N29 | 1.8° | 0.2° |
| C03 | C04 | C05 | C06 | 179.4° | 180.0° |
| C03 | C04 | C05 | C28 | 1.3° | 0.0° |
| C03 | C04 | C34 | H21 | 179.9° | 180.0° |
| C04 | C03 | N36 | H26 | 179.9° | 180.0° |
| C02 | C03 | C04 | C05 | 1.5° | 0.2° |
| C03 | C02 | O01 | N29 | 179.3° | 180.0° |
| C03 | C02 | N29 | C28 | 1.7° | 0.0° |
| C03 | C02 | N29 | C30 | 180.0° | 180.0° |
| C02 | C03 | N36 | H26 | 1.1° | 0.2° |
| C04 | C05 | C06 | N07 | 11.8° | 4.3° |
| C04 | C05 | C06 | C28 | 178.2° | 180.0° |
| C04 | C05 | C06 | C27 | 167.2° | 175.4° |
| C04 | C05 | C28 | N29 | 1.2° | 0.2° |
| C04 | C05 | C28 | H5 | 178.7° | 180.0° |
| C05 | C04 | C34 | H21 | 0.6° | 0.4° |
| C08 | N07 | C06 | C05 | 179.7° | 180.0° |
| C08 | N07 | C06 | C27 | 0.7° | 0.3° |
| N07 | C08 | N18 | C19 | 0.1° | 0.2° |
| C06 | N07 | C08 | N18 | 0.7° | 0.0° |
| N07 | C06 | C05 | C27 | 179.0° | 179.7° |
| N07 | C06 | C05 | C28 | 170.0° | 175.7° |
| N07 | C06 | C27 | C19 | 0.2° | 0.3° |
| N07 | C06 | C27 | H13 | 179.8° | 179.7° |
| C08 | N18 | C19 | C27 | 0.5° | 0.2° |
| C08 | N18 | C19 | C20 | 178.3° | 179.7° |
| O01 | C02 | N29 | C28 | 178.9° | 180.0° |
| O01 | C02 | N29 | C30 | 0.7° | 0.0° |
| C02 | N29 | C28 | C05 | 1.5° | 0.2° |
| C02 | N29 | C28 | C30 | 178.3° | 180.0° |
| C02 | N29 | C30 | C31 | 114.7° | 90.0° |
| C02 | N29 | C28 | H5 | 178.5° | 180.0° |
| C02 | N29 | C30 | H14 | 5.3° | 30.0° |
| C02 | N29 | C30 | H15 | 125.3° | 150.0° |
| C06 | C05 | C28 | N29 | 179.5° | 179.8° |
| C05 | C06 | C27 | C19 | 179.2° | 180.0° |
| C06 | C05 | C28 | H5 | 0.5° | 0.0° |
| C05 | C06 | C27 | H13 | 0.8° | 0.0° |
| C28 | C05 | C06 | C27 | 11.0° | 4.6° |
| C05 | C28 | N29 | H5 | 180.0° | 179.8° |
| C05 | C28 | N29 | C30 | 179.8° | 179.7° |
| C06 | C27 | C19 | N18 | 0.4° | 0.0° |
| C06 | C27 | C19 | H13 | 180.0° | 180.0° |
| C06 | C27 | C19 | C20 | 178.2° | 180.0° |
| N18 | C19 | C27 | C20 | 177.8° | 180.0° |
| N18 | C19 | C20 | S21 | 61.8° | 99.8° |
| N18 | C19 | C20 | C25 | 173.6° | 114.5° |
| N18 | C19 | C20 | C26 | 101.6° | 45.8° |
| N18 | C19 | C27 | H13 | 179.6° | 180.0° |
| C28 | N29 | C30 | C31 | 63.6° | 89.9° |
| C28 | N29 | C30 | H14 | 176.4° | 150.0° |
| C28 | N29 | C30 | H15 | 56.3° | 30.0° |
| N29 | C30 | C31 | H14 | 120.0° | 120.0° |
| N29 | C30 | C31 | H15 | 120.0° | 119.9° |
| N29 | C30 | C31 | C32 | 164.6° | 180.0° |
| C30 | N29 | C28 | H5 | 0.2° | 0.0° |
| N29 | C30 | H14 | H15 | 120.1° | 120.0° |
| N29 | C30 | C31 | H16 | 44.2° | 60.1° |
| N29 | C30 | C31 | H17 | 75.1° | 60.0° |
| C27 | C19 | C20 | S21 | 120.3° | 80.2° |
| C27 | C19 | C20 | C25 | 4.3° | 65.5° |
| C27 | C19 | C20 | C26 | 76.2° | 134.1° |
| C19 | C20 | S21 | O24 | 25.8° | 95.8° |
| C19 | C20 | S21 | C23 | 95.7° | 30.4° |
| C19 | C20 | S21 | C25 | 126.8° | 145.8° |
| C19 | C20 | S21 | C26 | 167.5° | 145.7° |
| C19 | C20 | S21 | N22 | 157.0° | 145.8° |
| C19 | C20 | C25 | C26 | 130.5° | 107.5° |
| C19 | C20 | C26 | H3 | 13.7° | 0.0° |
| C19 | C20 | C26 | H4 | 154.6° | 145.0° |
| C19 | C20 | C25 | H11 | 120.1° | 145.0° |
| C19 | C20 | C25 | H12 | 21.1° | 0.0° |
| C20 | C19 | C27 | H13 | 1.8° | 0.0° |
| O24 | S21 | C23 | C20 | 119.4° | 126.2° |
| O24 | S21 | C23 | N22 | 132.8° | 118.5° |
| O24 | S21 | C20 | N22 | 131.2° | 118.4° |
| O24 | S21 | C20 | C25 | 101.1° | 50.0° |
| O24 | S21 | C20 | C26 | 166.7° | 118.6° |
| O24 | S21 | C23 | H8 | 180.0° | 58.5° |
| O24 | S21 | C23 | H9 | 60.0° | 178.5° |
| O24 | S21 | C23 | H10 | 60.0° | 61.5° |
| O24 | S21 | N22 | H24 | 0.0° | 120.1° |
| C30 | C31 | C32 | H16 | 120.4° | 120.0° |
| C30 | C31 | C32 | H17 | 120.3° | 120.0° |
| C30 | C31 | C32 | C33 | 116.4° | 125.0° |
| C31 | C30 | H14 | H15 | 120.0° | 120.0° |
| C30 | C31 | H16 | H17 | 119.0° | 120.0° |
| C30 | C31 | C32 | H18 | 63.5° | 55.0° |
| C23 | S21 | C20 | N22 | 107.3° | 115.4° |
| C23 | S21 | C20 | C25 | 137.4° | 176.2° |
| C23 | S21 | C20 | C26 | 71.8° | 115.2° |
| S21 | C23 | H8 | H9 | 120.0° | 120.0° |
| S21 | C23 | H8 | H10 | 120.0° | 120.0° |
| S21 | C23 | H9 | H10 | 120.0° | 120.0° |
| C23 | S21 | N22 | H24 | 135.6° | 2.4° |
| C31 | C32 | C33 | H18 | 180.0° | 180.0° |
| C32 | C31 | C30 | H14 | 75.5° | 60.0° |
| C32 | C31 | C30 | H15 | 44.6° | 60.0° |
| C32 | C31 | H16 | H17 | 119.0° | 120.0° |
| C31 | C32 | C33 | H19 | 180.0° | 180.0° |
| C31 | C32 | C33 | H20 | 0.0° | 0.0° |
| S21 | C20 | C25 | C26 | 106.2° | 107.4° |
| S21 | C20 | C26 | H3 | 149.1° | 145.0° |
| S21 | C20 | C26 | H4 | 8.2° | 0.0° |
| C20 | S21 | C23 | H8 | 60.6° | 175.3° |
| C20 | S21 | C23 | H9 | 59.4° | 55.3° |
| C20 | S21 | C23 | H10 | 179.4° | 64.6° |
| S21 | C20 | C25 | H11 | 3.1° | 0.0° |
| S21 | C20 | C25 | H12 | 144.4° | 145.1° |
| C20 | S21 | N22 | H24 | 132.8° | 117.6° |
| N22 | S21 | C20 | C25 | 30.1° | 68.4° |
| N22 | S21 | C20 | C26 | 35.5° | 0.2° |
| N22 | S21 | C23 | H8 | 47.2° | 60.0° |
| N22 | S21 | C23 | H9 | 167.2° | 60.1° |
| N22 | S21 | C23 | H10 | 72.8° | 180.0° |
| C20 | C25 | C26 | H11 | 109.4° | 107.5° |
| C20 | C25 | C26 | H12 | 109.4° | 107.4° |
| C25 | C20 | C26 | H3 | 109.5° | 107.5° |
| C25 | C20 | C26 | H4 | 109.5° | 107.5° |
| C20 | C25 | H11 | H12 | 144.9° | 145.7° |
| C20 | C26 | H3 | H4 | 144.7° | 145.7° |
| C25 | C26 | H3 | H4 | 144.7° | 145.7° |
| C26 | C25 | H11 | H12 | 144.9° | 145.7° |
| C33 | C32 | C31 | H16 | 3.9° | 5.0° |
| C33 | C32 | C31 | H17 | 123.3° | 115.0° |
| C32 | C33 | H19 | H20 | 180.0° | 180.0° |
| H1 | C10 | C11 | H6 | 1.9° | 0.1° |
| H2 | C15 | C16 | H7 | 0.3° | 0.0° |
| H3 | C26 | C25 | H11 | 141.1° | 145.0° |
| H3 | C26 | C25 | H12 | 0.1° | 0.0° |
| H4 | C26 | C25 | H11 | 0.1° | 0.0° |
| H4 | C26 | C25 | H12 | 141.1° | 145.0° |
| H7 | C16 | N17 | H23 | 0.4° | 0.3° |
| H8 | C23 | H9 | H10 | 120.0° | 120.0° |
| H14 | C30 | C31 | H16 | 164.2° | 60.0° |
| H14 | C30 | C31 | H17 | 44.9° | 180.0° |
| H15 | C30 | C31 | H16 | 75.8° | 180.0° |
| H15 | C30 | C31 | H17 | 164.9° | 60.0° |
| H16 | C31 | C32 | H18 | 176.1° | 175.0° |
| H17 | C31 | C32 | H18 | 56.8° | 65.0° |
| H18 | C32 | C33 | H19 | 0.0° | 0.0° |
| H18 | C32 | C33 | H20 | 179.9° | 180.0° |
| H21 | C34 | C35 | H22 | 0.2° | 0.1° |
| H22 | C35 | N36 | H26 | 0.2° | 0.3° |
