7TF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N28 | C27 | sing | 1.49Å | 1.47Å | |
| N28 | C29 | sing | 1.49Å | 1.48Å | |
| C27 | C25 | sing | 1.51Å | 1.50Å | |
| C27 | C31 | sing | 1.54Å | 1.52Å | |
| C29 | C30 | sing | 1.54Å | 1.52Å | |
| O26 | C25 | doub | 1.21Å | 1.22Å | |
| C25 | N24 | sing | 1.35Å | 1.34Å | |
| C31 | C30 | sing | 1.54Å | 1.51Å | |
| N24 | C22 | sing | 1.47Å | 1.46Å | |
| C30 | F32 | sing | 1.40Å | 1.37Å | |
| C22 | C21 | sing | 1.54Å | 1.52Å | |
| C22 | C23 | sing | 1.55Å | 1.51Å | |
| C21 | N20 | sing | 1.47Å | 1.46Å | |
| C23 | C19 | sing | 1.55Å | 1.52Å | |
| N20 | C19 | sing | 1.47Å | 1.47Å | |
| N20 | C33 | sing | 1.35Å | 1.34Å | |
| O18 | C17 | doub | 1.21Å | 1.22Å | |
| C19 | C17 | sing | 1.51Å | 1.52Å | |
| C17 | N16 | sing | 1.35Å | 1.34Å | |
| O34 | C33 | doub | 1.21Å | 1.22Å | |
| C33 | C35 | sing | 1.51Å | 1.50Å | |
| N16 | C1 | sing | 1.46Å | 1.45Å | |
| C1 | C2 | sing | 1.51Å | 1.52Å | |
| C3 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.40Å | Aromatic |
| C2 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
| C35 | C37 | sing | 1.53Å | 1.53Å | |
| C35 | C36 | sing | 1.53Å | 1.52Å | |
| C4 | C5 | doub | 1.40Å | 1.40Å | Aromatic |
| C37 | C36 | sing | 1.53Å | 1.53Å | |
| C7 | C6 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.39Å | Aromatic |
| C5 | C8 | sing | 1.43Å | 1.30Å | |
| C8 | C9 | trip | 1.17Å | 1.20Å | |
| C9 | C10 | sing | 1.43Å | 1.30Å | |
| C10 | C11 | doub | 1.40Å | 1.39Å | Aromatic |
| C10 | C15 | sing | 1.40Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | C16 | sing | 1.51Å | 1.51Å | |
| C24 | C20 | sing | 1.53Å | 1.52Å | |
| C24 | O36 | sing | 1.43Å | 1.43Å | |
| C20 | N18 | sing | 1.47Å | 1.48Å | |
| N18 | C16 | sing | 1.47Å | 1.46Å | |
| N18 | C32 | sing | 1.47Å | 1.47Å | |
| O36 | C28 | sing | 1.43Å | 1.42Å | |
| C28 | C32 | sing | 1.53Å | 1.52Å | |
| C7 | H1 | sing | 1.08Å | 1.08Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.08Å | 1.08Å | |
| C4 | H6 | sing | 1.08Å | 1.08Å | |
| C14 | H7 | sing | 1.08Å | 1.08Å | |
| C15 | H8 | sing | 1.08Å | 1.08Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.08Å | 1.08Å | |
| C11 | H12 | sing | 1.08Å | 1.08Å | |
| N16 | H13 | sing | 0.97Å | 1.00Å | |
| C19 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.09Å | 1.10Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| N24 | H20 | sing | 0.97Å | 1.00Å | |
| C27 | H21 | sing | 1.09Å | 1.10Å | |
| N28 | H22 | sing | 1.01Å | 1.00Å | |
| C29 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| C30 | H26 | sing | 1.09Å | 1.10Å | |
| C31 | H27 | sing | 1.09Å | 1.10Å | |
| C31 | H28 | sing | 1.09Å | 1.10Å | |
| C35 | H29 | sing | 1.09Å | 1.10Å | |
| C36 | H30 | sing | 1.09Å | 1.10Å | |
| C36 | H31 | sing | 1.09Å | 1.10Å | |
| C37 | H32 | sing | 1.09Å | 1.10Å | |
| C37 | H33 | sing | 1.09Å | 1.10Å | |
| C20 | H35 | sing | 1.09Å | 1.10Å | |
| C20 | H36 | sing | 1.09Å | 1.10Å | |
| C24 | H37 | sing | 1.09Å | 1.10Å | |
| C24 | H38 | sing | 1.09Å | 1.10Å | |
| C28 | H39 | sing | 1.09Å | 1.10Å | |
| C28 | H40 | sing | 1.09Å | 1.10Å | |
| C32 | H41 | sing | 1.09Å | 1.10Å | |
| C32 | H42 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C27 | N28 | C29 | 108.3° | 104.2° |
| N28 | C27 | C25 | 109.1° | 110.4° |
| N28 | C27 | C31 | 105.8° | 104.6° |
| N28 | C27 | H21 | 110.5° | 110.5° |
| C27 | N28 | H22 | 109.8° | 111.0° |
| N28 | C29 | C30 | 107.7° | 104.6° |
| C29 | N28 | H22 | 109.7° | 111.0° |
| N28 | C29 | H24 | 109.9° | 110.4° |
| N28 | C29 | H25 | 109.9° | 110.4° |
| C25 | C27 | C31 | 111.2° | 110.4° |
| C27 | C25 | O26 | 118.8° | 120.0° |
| C27 | C25 | N24 | 117.7° | 120.0° |
| C25 | C27 | H21 | 110.1° | 110.4° |
| C27 | C31 | C30 | 105.2° | 105.1° |
| C31 | C27 | H21 | 109.9° | 110.4° |
| C27 | C31 | H27 | 110.5° | 110.3° |
| C27 | C31 | H28 | 110.5° | 110.3° |
| C29 | C30 | C31 | 105.3° | 105.0° |
| C29 | C30 | F32 | 110.3° | 110.3° |
| C30 | C29 | H24 | 109.9° | 110.4° |
| C30 | C29 | H25 | 109.9° | 110.4° |
| C29 | C30 | H26 | 110.0° | 110.3° |
| O26 | C25 | N24 | 123.5° | 120.0° |
| C25 | N24 | C22 | 122.8° | 120.0° |
| C25 | N24 | H20 | 118.6° | 120.0° |
| C31 | C30 | F32 | 108.5° | 110.3° |
| C31 | C30 | H26 | 110.1° | 110.4° |
| C30 | C31 | H27 | 110.5° | 110.3° |
| C30 | C31 | H28 | 110.5° | 110.4° |
| N24 | C22 | C21 | 110.4° | 110.8° |
| N24 | C22 | C23 | 111.5° | 110.7° |
| N24 | C22 | H17 | 110.8° | 110.7° |
| C22 | N24 | H20 | 118.6° | 120.0° |
| F32 | C30 | H26 | 112.4° | 110.3° |
| C21 | C22 | C23 | 104.0° | 103.0° |
| C22 | C21 | N20 | 104.7° | 107.3° |
| C22 | C21 | H15 | 110.6° | 109.9° |
| C22 | C21 | H16 | 110.6° | 110.0° |
| C21 | C22 | H17 | 109.9° | 110.8° |
| C22 | C23 | C19 | 105.0° | 101.5° |
| C23 | C22 | H17 | 110.0° | 110.6° |
| C22 | C23 | H18 | 110.6° | 111.0° |
| C22 | C23 | H19 | 110.6° | 111.0° |
| C21 | N20 | C19 | 112.1° | 108.7° |
| C21 | N20 | C33 | 125.8° | 125.6° |
| N20 | C21 | H15 | 110.7° | 109.9° |
| N20 | C21 | H16 | 110.6° | 109.9° |
| C23 | C19 | N20 | 102.4° | 105.0° |
| C23 | C19 | C17 | 109.5° | 110.4° |
| C23 | C19 | H14 | 109.2° | 110.4° |
| C19 | C23 | H18 | 110.6° | 111.2° |
| C19 | C23 | H19 | 110.5° | 110.9° |
| C19 | N20 | C33 | 122.1° | 125.7° |
| N20 | C19 | C17 | 116.3° | 110.4° |
| N20 | C19 | H14 | 109.9° | 110.4° |
| N20 | C33 | O34 | 122.9° | 120.0° |
| N20 | C33 | C35 | 118.7° | 120.0° |
| O18 | C17 | C19 | 121.6° | 120.0° |
| O18 | C17 | N16 | 123.1° | 120.0° |
| C19 | C17 | N16 | 115.3° | 120.0° |
| C17 | C19 | H14 | 109.2° | 110.3° |
| C17 | N16 | C1 | 124.0° | 120.0° |
| C17 | N16 | H13 | 118.0° | 120.0° |
| O34 | C33 | C35 | 118.4° | 120.0° |
| C33 | C35 | C37 | 113.5° | 117.5° |
| C33 | C35 | C36 | 116.4° | 117.5° |
| C33 | C35 | H29 | 118.3° | 115.6° |
| N16 | C1 | C2 | 110.1° | 109.4° |
| N16 | C1 | H3 | 109.3° | 109.5° |
| N16 | C1 | H4 | 109.3° | 109.5° |
| C1 | N16 | H13 | 118.0° | 120.0° |
| C1 | C2 | C3 | 121.5° | 119.8° |
| C1 | C2 | C7 | 119.9° | 119.9° |
| C2 | C1 | H3 | 109.3° | 109.5° |
| C2 | C1 | H4 | 109.3° | 109.4° |
| C2 | C3 | C4 | 120.4° | 120.2° |
| C3 | C2 | C7 | 118.6° | 120.3° |
| C2 | C3 | H5 | 119.8° | 119.9° |
| C3 | C4 | C5 | 121.0° | 119.8° |
| C4 | C3 | H5 | 119.8° | 119.9° |
| C3 | C4 | H6 | 119.5° | 120.1° |
| C2 | C7 | C6 | 121.0° | 120.2° |
| C2 | C7 | H1 | 119.5° | 119.9° |
| C37 | C35 | C36 | 60.1° | 60.0° |
| C35 | C37 | C36 | 59.8° | 60.0° |
| C37 | C35 | H29 | 117.7° | 117.5° |
| C35 | C37 | H32 | 120.0° | 117.6° |
| C35 | C37 | H33 | 120.0° | 117.5° |
| C35 | C36 | C37 | 60.1° | 60.0° |
| C36 | C35 | H29 | 117.7° | 117.5° |
| C35 | C36 | H30 | 120.0° | 117.5° |
| C35 | C36 | H31 | 120.0° | 117.6° |
| C4 | C5 | C6 | 118.4° | 119.7° |
| C4 | C5 | C8 | 122.8° | 120.1° |
| C5 | C4 | H6 | 119.5° | 120.1° |
| C37 | C36 | H30 | 120.0° | 117.5° |
| C37 | C36 | H31 | 120.0° | 117.5° |
| C36 | C37 | H32 | 120.0° | 117.5° |
| C36 | C37 | H33 | 120.0° | 117.5° |
| C7 | C6 | C5 | 120.6° | 119.8° |
| C6 | C7 | H1 | 119.5° | 119.9° |
| C7 | C6 | H2 | 119.7° | 120.1° |
| C6 | C5 | C8 | 118.9° | 120.2° |
| C5 | C6 | H2 | 119.7° | 120.1° |
| C5 | C8 | C9 | 174.4° | 180.0° |
| C8 | C9 | C10 | 172.6° | 180.0° |
| C9 | C10 | C11 | 120.9° | 120.2° |
| C9 | C10 | C15 | 120.0° | 120.2° |
| C11 | C10 | C15 | 119.0° | 119.7° |
| C10 | C11 | C12 | 120.5° | 119.9° |
| C10 | C11 | H12 | 119.8° | 120.1° |
| C10 | C15 | C14 | 120.5° | 119.8° |
| C10 | C15 | H8 | 119.8° | 120.1° |
| C11 | C12 | C13 | 119.8° | 120.2° |
| C11 | C12 | H11 | 120.1° | 119.9° |
| C12 | C11 | H12 | 119.7° | 120.1° |
| C15 | C14 | C13 | 120.3° | 120.2° |
| C15 | C14 | H7 | 119.8° | 119.9° |
| C14 | C15 | H8 | 119.7° | 120.1° |
| C12 | C13 | C14 | 119.8° | 120.3° |
| C12 | C13 | C16 | 121.2° | 119.9° |
| C13 | C12 | H11 | 120.1° | 119.9° |
| C14 | C13 | C16 | 119.0° | 119.8° |
| C13 | C14 | H7 | 119.9° | 120.0° |
| C13 | C16 | N18 | 111.8° | 109.5° |
| C13 | C16 | H9 | 108.9° | 109.4° |
| C13 | C16 | H10 | 108.9° | 109.5° |
| C20 | C24 | O36 | 108.9° | 109.3° |
| C24 | C20 | N18 | 111.8° | 109.2° |
| C24 | C20 | H35 | 108.9° | 109.5° |
| C24 | C20 | H36 | 108.9° | 109.5° |
| C20 | C24 | H37 | 109.6° | 109.5° |
| C20 | C24 | H38 | 109.6° | 109.5° |
| C24 | O36 | C28 | 111.1° | 113.7° |
| O36 | C24 | H37 | 109.6° | 109.5° |
| O36 | C24 | H38 | 109.6° | 109.5° |
| C20 | N18 | C16 | 106.7° | 111.0° |
| C20 | N18 | C32 | 112.9° | 110.8° |
| N18 | C20 | H35 | 108.9° | 109.5° |
| N18 | C20 | H36 | 108.9° | 109.6° |
| C16 | N18 | C32 | 105.6° | 111.0° |
| N18 | C16 | H9 | 108.9° | 109.5° |
| N18 | C16 | H10 | 108.9° | 109.5° |
| N18 | C32 | C28 | 111.6° | 109.3° |
| N18 | C32 | H41 | 108.9° | 109.5° |
| N18 | C32 | H42 | 109.0° | 109.5° |
| O36 | C28 | C32 | 109.9° | 109.2° |
| O36 | C28 | H39 | 109.3° | 109.5° |
| O36 | C28 | H40 | 109.4° | 109.5° |
| C32 | C28 | H39 | 109.4° | 109.5° |
| C32 | C28 | H40 | 109.4° | 109.5° |
| C28 | C32 | H41 | 108.9° | 109.5° |
| C28 | C32 | H42 | 108.9° | 109.5° |
| H3 | C1 | H4 | 109.5° | 109.5° |
| H9 | C16 | H10 | 109.4° | 109.5° |
| H15 | C21 | H16 | 109.5° | 109.8° |
| H18 | C23 | H19 | 109.5° | 110.9° |
| H24 | C29 | H25 | 109.4° | 110.5° |
| H27 | C31 | H28 | 109.5° | 110.4° |
| H30 | C36 | H31 | 109.5° | 115.6° |
| H32 | C37 | H33 | 109.5° | 115.5° |
| H35 | C20 | H36 | 109.5° | 109.5° |
| H37 | C24 | H38 | 109.4° | 109.5° |
| H39 | C28 | H40 | 109.4° | 109.6° |
| H41 | C32 | H42 | 109.4° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C27 | N28 | C29 | H22 | 119.8° | 119.5° |
| N28 | C27 | C25 | C31 | 116.4° | 115.2° |
| N28 | C27 | C25 | H21 | 121.5° | 122.5° |
| N28 | C27 | C31 | H21 | 119.4° | 118.9° |
| C27 | N28 | C29 | C30 | 6.0° | 39.5° |
| N28 | C27 | C25 | O26 | 1.8° | 15.1° |
| N28 | C27 | C25 | N24 | 176.4° | 164.8° |
| N28 | C27 | C31 | C30 | 28.2° | 23.8° |
| C27 | N28 | C29 | H24 | 125.7° | 79.3° |
| C27 | N28 | C29 | H25 | 113.8° | 158.3° |
| N28 | C27 | C31 | H27 | 147.5° | 95.0° |
| N28 | C27 | C31 | H28 | 91.2° | 142.8° |
| C29 | N28 | C27 | C25 | 98.5° | 158.2° |
| C29 | N28 | C27 | C31 | 21.2° | 39.5° |
| N28 | C29 | C30 | H24 | 119.7° | 118.8° |
| N28 | C29 | C30 | H25 | 119.7° | 118.8° |
| N28 | C29 | C30 | C31 | 11.6° | 23.9° |
| N28 | C29 | C30 | F32 | 105.2° | 95.0° |
| C29 | N28 | C27 | H21 | 140.2° | 79.3° |
| N28 | C29 | H24 | H25 | 120.8° | 122.4° |
| N28 | C29 | C30 | H26 | 130.3° | 142.9° |
| C25 | C27 | C31 | H21 | 122.2° | 122.3° |
| C27 | C25 | O26 | N24 | 178.1° | 179.9° |
| C25 | C27 | C31 | C30 | 90.2° | 142.6° |
| C27 | C25 | N24 | C22 | 175.1° | 179.9° |
| C27 | C25 | N24 | H20 | 4.9° | 0.1° |
| C25 | C27 | N28 | H22 | 141.7° | 82.2° |
| C25 | C27 | C31 | H27 | 29.1° | 23.8° |
| C25 | C27 | C31 | H28 | 150.5° | 98.5° |
| C27 | C31 | C30 | C29 | 24.2° | 0.0° |
| C31 | C27 | C25 | O26 | 114.6° | 100.1° |
| C31 | C27 | C25 | N24 | 67.2° | 80.1° |
| C27 | C31 | C30 | H27 | 119.3° | 118.9° |
| C27 | C31 | C30 | H28 | 119.3° | 118.9° |
| C27 | C31 | C30 | F32 | 93.8° | 118.9° |
| C31 | C27 | N28 | H22 | 98.6° | 159.1° |
| C27 | C31 | C30 | H26 | 142.8° | 118.9° |
| C27 | C31 | H27 | H28 | 122.0° | 122.2° |
| C29 | C30 | C31 | F32 | 118.1° | 118.9° |
| C29 | C30 | C31 | H26 | 118.6° | 118.9° |
| C29 | C30 | F32 | H26 | 123.1° | 122.1° |
| C30 | C29 | N28 | H22 | 113.8° | 159.0° |
| C30 | C29 | H24 | H25 | 120.8° | 122.4° |
| C29 | C30 | C31 | H27 | 143.6° | 118.9° |
| C29 | C30 | C31 | H28 | 95.1° | 118.9° |
| O26 | C25 | N24 | C22 | 3.0° | 0.1° |
| O26 | C25 | N24 | H20 | 177.0° | 180.0° |
| O26 | C25 | C27 | H21 | 123.3° | 137.6° |
| C25 | N24 | C22 | H20 | 180.0° | 180.0° |
| C25 | N24 | C22 | C21 | 178.2° | 86.5° |
| C25 | N24 | C22 | C23 | 66.8° | 159.9° |
| C25 | N24 | C22 | H17 | 56.1° | 36.8° |
| N24 | C25 | C27 | H21 | 54.9° | 42.3° |
| C31 | C30 | F32 | H26 | 122.0° | 122.3° |
| C30 | C31 | C27 | H21 | 147.6° | 95.1° |
| C31 | C30 | C29 | H24 | 108.1° | 94.9° |
| C31 | C30 | C29 | H25 | 131.4° | 142.7° |
| C30 | C31 | H27 | H28 | 122.0° | 122.2° |
| N24 | C22 | C21 | C23 | 119.7° | 118.4° |
| N24 | C22 | C21 | H17 | 122.6° | 123.3° |
| N24 | C22 | C23 | H17 | 123.4° | 123.2° |
| N24 | C22 | C21 | N20 | 97.3° | 140.6° |
| N24 | C22 | C23 | C19 | 84.9° | 153.8° |
| N24 | C22 | C21 | H15 | 143.5° | 21.1° |
| N24 | C22 | C21 | H16 | 22.0° | 99.9° |
| N24 | C22 | C23 | H18 | 34.4° | 88.0° |
| N24 | C22 | C23 | H19 | 155.8° | 35.9° |
| F32 | C30 | C29 | H24 | 135.0° | 146.2° |
| F32 | C30 | C29 | H25 | 14.5° | 23.8° |
| F32 | C30 | C31 | H27 | 25.5° | 0.0° |
| F32 | C30 | C31 | H28 | 146.8° | 122.2° |
| C21 | C22 | C23 | H17 | 117.7° | 118.4° |
| C22 | C21 | N20 | H15 | 119.2° | 119.4° |
| C22 | C21 | N20 | H16 | 119.2° | 119.6° |
| C21 | C22 | C23 | C19 | 34.0° | 35.4° |
| C22 | C21 | N20 | C19 | 2.5° | 1.0° |
| C22 | C21 | N20 | C33 | 178.5° | 178.9° |
| C22 | C21 | H15 | H16 | 122.2° | 121.1° |
| C21 | C22 | C23 | H18 | 153.4° | 153.6° |
| C21 | C22 | C23 | H19 | 85.2° | 82.6° |
| C21 | C22 | N24 | H20 | 1.8° | 93.5° |
| C23 | C22 | C21 | N20 | 22.4° | 22.1° |
| C22 | C23 | C19 | H18 | 119.3° | 118.1° |
| C22 | C23 | C19 | H19 | 119.3° | 118.0° |
| C22 | C23 | C19 | N20 | 31.9° | 36.9° |
| C22 | C23 | C19 | C17 | 92.1° | 155.8° |
| C22 | C23 | C19 | H14 | 148.4° | 82.0° |
| C23 | C22 | C21 | H15 | 96.8° | 97.3° |
| C23 | C22 | C21 | H16 | 141.6° | 141.6° |
| C22 | C23 | H18 | H19 | 122.1° | 123.9° |
| C23 | C22 | N24 | H20 | 113.2° | 20.1° |
| C21 | N20 | C19 | C23 | 18.3° | 24.1° |
| C21 | N20 | C19 | C33 | 179.1° | 179.9° |
| C21 | N20 | C19 | C17 | 101.0° | 143.0° |
| C21 | N20 | C33 | O34 | 4.3° | 174.8° |
| C21 | N20 | C33 | C35 | 174.8° | 5.1° |
| C21 | N20 | C19 | H14 | 134.3° | 94.9° |
| N20 | C21 | H15 | H16 | 122.2° | 121.0° |
| N20 | C21 | C22 | H17 | 140.2° | 96.2° |
| C23 | C19 | N20 | C17 | 119.3° | 118.9° |
| C23 | C19 | N20 | H14 | 116.0° | 118.9° |
| C23 | C19 | N20 | C33 | 160.8° | 155.8° |
| C23 | C19 | C17 | O18 | 97.2° | 85.8° |
| C23 | C19 | C17 | H14 | 119.5° | 122.2° |
| C23 | C19 | C17 | N16 | 82.2° | 94.1° |
| C19 | C23 | C22 | H17 | 151.7° | 83.0° |
| C19 | C23 | H18 | H19 | 122.0° | 123.9° |
| N20 | C19 | C17 | O18 | 18.3° | 29.7° |
| N20 | C19 | C17 | H14 | 125.0° | 122.2° |
| N20 | C19 | C17 | N16 | 162.4° | 150.3° |
| C19 | N20 | C33 | O34 | 174.6° | 5.3° |
| C19 | N20 | C33 | C35 | 6.2° | 174.8° |
| C19 | N20 | C21 | H15 | 116.7° | 120.5° |
| C19 | N20 | C21 | H16 | 121.7° | 118.5° |
| N20 | C19 | C23 | H18 | 151.2° | 154.9° |
| N20 | C19 | C23 | H19 | 87.4° | 81.1° |
| C33 | N20 | C19 | C17 | 79.9° | 36.9° |
| N20 | C33 | O34 | C35 | 179.1° | 179.9° |
| N20 | C33 | C35 | C37 | 139.8° | 180.0° |
| N20 | C33 | C35 | C36 | 153.3° | 111.4° |
| C33 | N20 | C19 | H14 | 44.8° | 85.2° |
| C33 | N20 | C21 | H15 | 62.3° | 59.4° |
| C33 | N20 | C21 | H16 | 59.2° | 61.5° |
| N20 | C33 | C35 | H29 | 4.3° | 34.2° |
| O18 | C17 | C19 | N16 | 179.4° | 179.9° |
| O18 | C17 | N16 | C1 | 0.4° | 0.0° |
| O18 | C17 | N16 | H13 | 179.7° | 180.0° |
| O18 | C17 | C19 | H14 | 143.3° | 151.9° |
| C19 | C17 | N16 | C1 | 179.0° | 180.0° |
| C19 | C17 | N16 | H13 | 1.0° | 0.0° |
| C17 | C19 | C23 | H18 | 27.2° | 86.1° |
| C17 | C19 | C23 | H19 | 148.6° | 37.8° |
| C17 | N16 | C1 | H13 | 180.0° | 180.0° |
| C17 | N16 | C1 | C2 | 177.1° | 180.0° |
| C17 | N16 | C1 | H3 | 57.0° | 60.0° |
| C17 | N16 | C1 | H4 | 62.8° | 60.0° |
| N16 | C17 | C19 | H14 | 37.3° | 28.1° |
| O34 | C33 | C35 | C37 | 39.4° | 0.1° |
| O34 | C33 | C35 | C36 | 27.5° | 68.7° |
| O34 | C33 | C35 | H29 | 176.5° | 145.7° |
| C33 | C35 | C37 | C36 | 107.9° | 107.4° |
| C33 | C35 | C37 | H29 | 144.3° | 145.1° |
| C33 | C35 | C36 | H29 | 149.2° | 145.0° |
| C33 | C35 | C36 | H30 | 147.3° | 145.0° |
| C33 | C35 | C36 | H31 | 6.3° | 0.0° |
| C33 | C35 | C37 | H32 | 1.5° | 0.1° |
| C33 | C35 | C37 | H33 | 142.6° | 145.1° |
| N16 | C1 | C2 | H3 | 120.1° | 120.1° |
| N16 | C1 | C2 | H4 | 120.1° | 119.9° |
| N16 | C1 | C2 | C3 | 63.5° | 90.1° |
| N16 | C1 | C2 | C7 | 116.1° | 90.0° |
| N16 | C1 | H3 | H4 | 119.7° | 120.0° |
| C1 | C2 | C3 | C7 | 179.6° | 179.9° |
| C1 | C2 | C3 | C4 | 180.0° | 180.0° |
| C1 | C2 | C7 | C6 | 179.9° | 180.0° |
| C1 | C2 | C7 | H1 | 0.2° | 0.2° |
| C2 | C1 | H3 | H4 | 119.7° | 120.0° |
| C1 | C2 | C3 | H5 | 0.0° | 0.0° |
| C2 | C1 | N16 | H13 | 2.9° | 0.0° |
| C2 | C3 | C4 | H5 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.3° | 0.2° |
| C3 | C2 | C7 | C6 | 0.2° | 0.1° |
| C3 | C2 | C7 | H1 | 179.8° | 179.7° |
| C3 | C2 | C1 | H3 | 176.4° | 30.0° |
| C3 | C2 | C1 | H4 | 56.6° | 150.0° |
| C2 | C3 | C4 | H6 | 179.7° | 180.0° |
| C4 | C3 | C2 | C7 | 0.4° | 0.1° |
| C3 | C4 | C5 | H6 | 180.0° | 179.8° |
| C3 | C4 | C5 | C6 | 0.0° | 0.4° |
| C3 | C4 | C5 | C8 | 179.9° | 180.0° |
| C2 | C7 | C6 | H1 | 180.0° | 179.8° |
| C2 | C7 | C6 | C5 | 0.1° | 0.2° |
| C2 | C7 | C6 | H2 | 179.9° | 179.8° |
| C7 | C2 | C1 | H3 | 4.0° | 149.9° |
| C7 | C2 | C1 | H4 | 123.8° | 29.9° |
| C7 | C2 | C3 | H5 | 179.6° | 179.9° |
| C37 | C35 | C36 | H29 | 107.6° | 107.5° |
| C35 | C37 | C36 | H32 | 109.4° | 107.6° |
| C35 | C37 | C36 | H33 | 109.4° | 107.5° |
| C37 | C35 | C36 | H30 | 109.5° | 107.5° |
| C37 | C35 | C36 | H31 | 109.5° | 107.5° |
| C35 | C37 | H32 | H33 | 144.8° | 145.7° |
| C35 | C36 | H30 | H31 | 144.7° | 145.7° |
| C4 | C5 | C6 | C7 | 0.2° | 0.4° |
| C4 | C5 | C6 | C8 | 179.9° | 179.6° |
| C4 | C5 | C8 | C9 | 163.8° | 166.1° |
| C4 | C5 | C6 | H2 | 179.8° | 179.6° |
| C5 | C4 | C3 | H5 | 179.7° | 179.8° |
| C37 | C36 | H30 | H31 | 144.7° | 145.7° |
| C36 | C37 | H32 | H33 | 144.9° | 145.6° |
| C7 | C6 | C5 | H2 | 180.0° | 180.0° |
| C7 | C6 | C5 | C8 | 179.7° | 180.0° |
| C6 | C5 | C8 | C9 | 16.3° | 13.5° |
| C5 | C6 | C7 | H1 | 179.9° | 180.0° |
| C6 | C5 | C4 | H6 | 180.0° | 179.8° |
| C5 | C8 | C9 | C10 | 15.2° | 100.5° |
| C8 | C5 | C6 | H2 | 0.3° | 0.0° |
| C8 | C5 | C4 | H6 | 0.1° | 0.2° |
| C8 | C9 | C10 | C11 | 107.2° | 86.6° |
| C8 | C9 | C10 | C15 | 70.1° | 93.2° |
| C9 | C10 | C11 | C15 | 177.2° | 179.8° |
| C9 | C10 | C11 | C12 | 178.4° | 180.0° |
| C9 | C10 | C15 | C14 | 178.4° | 180.0° |
| C9 | C10 | C15 | H8 | 1.6° | 0.0° |
| C9 | C10 | C11 | H12 | 1.6° | 0.1° |
| C10 | C11 | C12 | H12 | 180.0° | 179.9° |
| C11 | C10 | C15 | C14 | 1.1° | 0.2° |
| C10 | C11 | C12 | C13 | 0.5° | 0.1° |
| C11 | C10 | C15 | H8 | 178.9° | 179.8° |
| C10 | C11 | C12 | H11 | 179.5° | 179.7° |
| C15 | C10 | C11 | C12 | 1.2° | 0.2° |
| C10 | C15 | C14 | H8 | 180.0° | 180.0° |
| C10 | C15 | C14 | C13 | 0.4° | 0.0° |
| C10 | C15 | C14 | H7 | 179.6° | 179.8° |
| C15 | C10 | C11 | H12 | 178.9° | 179.7° |
| C11 | C12 | C13 | H11 | 180.0° | 179.6° |
| C11 | C12 | C13 | C14 | 0.2° | 0.3° |
| C11 | C12 | C13 | C16 | 179.2° | 179.7° |
| C15 | C14 | C13 | C12 | 0.3° | 0.3° |
| C15 | C14 | C13 | H7 | 180.0° | 179.8° |
| C15 | C14 | C13 | C16 | 179.2° | 179.8° |
| C12 | C13 | C14 | C16 | 179.0° | 180.0° |
| C12 | C13 | C16 | N18 | 44.1° | 89.9° |
| C12 | C13 | C14 | H7 | 179.7° | 179.9° |
| C12 | C13 | C16 | H9 | 76.3° | 30.0° |
| C12 | C13 | C16 | H10 | 164.4° | 150.0° |
| C13 | C12 | C11 | H12 | 179.5° | 179.9° |
| C14 | C13 | C16 | N18 | 137.0° | 90.0° |
| C13 | C14 | C15 | H8 | 179.6° | 180.0° |
| C14 | C13 | C16 | H9 | 102.7° | 150.0° |
| C14 | C13 | C16 | H10 | 16.6° | 30.0° |
| C14 | C13 | C12 | H11 | 179.8° | 179.9° |
| C13 | C16 | N18 | C20 | 86.1° | 66.4° |
| C13 | C16 | N18 | H9 | 120.4° | 119.9° |
| C13 | C16 | N18 | H10 | 120.4° | 120.1° |
| C13 | C16 | N18 | C32 | 153.4° | 170.0° |
| C16 | C13 | C14 | H7 | 0.7° | 0.0° |
| C13 | C16 | H9 | H10 | 118.9° | 120.0° |
| C16 | C13 | C12 | H11 | 0.8° | 0.1° |
| C20 | C24 | O36 | H37 | 119.9° | 119.9° |
| C20 | C24 | O36 | H38 | 119.9° | 120.0° |
| C24 | C20 | N18 | H35 | 120.3° | 119.9° |
| C24 | C20 | N18 | H36 | 120.3° | 119.9° |
| C24 | C20 | N18 | C16 | 164.1° | 177.6° |
| C24 | C20 | N18 | C32 | 48.4° | 58.6° |
| C20 | C24 | O36 | C28 | 63.7° | 58.7° |
| C24 | C20 | H35 | H36 | 118.9° | 120.1° |
| C20 | C24 | H37 | H38 | 120.2° | 120.1° |
| O36 | C24 | C20 | N18 | 55.4° | 56.9° |
| C24 | O36 | C28 | C32 | 63.3° | 58.7° |
| O36 | C24 | C20 | H35 | 175.8° | 63.1° |
| O36 | C24 | C20 | H36 | 64.9° | 176.8° |
| O36 | C24 | H37 | H38 | 120.3° | 120.1° |
| C24 | O36 | C28 | H39 | 176.7° | 178.6° |
| C24 | O36 | C28 | H40 | 56.8° | 61.3° |
| C20 | N18 | C16 | C32 | 120.4° | 123.6° |
| C20 | N18 | C32 | C28 | 47.4° | 58.7° |
| C20 | N18 | C16 | H9 | 153.5° | 173.7° |
| C20 | N18 | C16 | H10 | 34.2° | 53.7° |
| N18 | C20 | H35 | H36 | 119.0° | 120.2° |
| N18 | C20 | C24 | H37 | 175.4° | 176.8° |
| N18 | C20 | C24 | H38 | 64.5° | 63.1° |
| C20 | N18 | C32 | H41 | 167.7° | 178.6° |
| C20 | N18 | C32 | H42 | 73.0° | 61.3° |
| C16 | N18 | C32 | C28 | 163.6° | 177.6° |
| N18 | C16 | H9 | H10 | 118.9° | 120.0° |
| C16 | N18 | C20 | H35 | 75.6° | 62.4° |
| C16 | N18 | C20 | H36 | 43.7° | 57.7° |
| C16 | N18 | C32 | H41 | 76.0° | 57.7° |
| C16 | N18 | C32 | H42 | 43.3° | 62.4° |
| N18 | C32 | C28 | O36 | 53.9° | 56.9° |
| N18 | C32 | C28 | H41 | 120.3° | 119.9° |
| N18 | C32 | C28 | H42 | 120.4° | 119.9° |
| C32 | N18 | C16 | H9 | 33.1° | 50.1° |
| C32 | N18 | C16 | H10 | 86.2° | 69.9° |
| C32 | N18 | C20 | H35 | 168.8° | 61.3° |
| C32 | N18 | C20 | H36 | 71.9° | 178.6° |
| N18 | C32 | C28 | H39 | 173.9° | 176.8° |
| N18 | C32 | C28 | H40 | 66.2° | 63.0° |
| N18 | C32 | H41 | H42 | 119.0° | 120.1° |
| O36 | C28 | C32 | H39 | 120.0° | 119.9° |
| O36 | C28 | C32 | H40 | 120.1° | 119.9° |
| C28 | O36 | C24 | H37 | 176.4° | 178.6° |
| C28 | O36 | C24 | H38 | 56.2° | 61.3° |
| O36 | C28 | H39 | H40 | 119.8° | 120.1° |
| O36 | C28 | C32 | H41 | 174.2° | 176.8° |
| O36 | C28 | C32 | H42 | 66.5° | 63.1° |
| C32 | C28 | H39 | H40 | 119.8° | 120.2° |
| C28 | C32 | H41 | H42 | 119.0° | 120.1° |
| H1 | C7 | C6 | H2 | 0.1° | 0.0° |
| H3 | C1 | N16 | H13 | 123.0° | 120.0° |
| H4 | C1 | N16 | H13 | 117.2° | 120.0° |
| H5 | C3 | C4 | H6 | 0.3° | 0.0° |
| H7 | C14 | C15 | H8 | 0.4° | 0.2° |
| H11 | C12 | C11 | H12 | 0.5° | 0.4° |
| H14 | C19 | C23 | H18 | 92.3° | 36.0° |
| H14 | C19 | C23 | H19 | 29.1° | 160.0° |
| H15 | C21 | C22 | H17 | 20.9° | 144.4° |
| H16 | C21 | C22 | H17 | 100.6° | 23.4° |
| H17 | C22 | C23 | H18 | 89.0° | 35.2° |
| H17 | C22 | C23 | H19 | 32.5° | 159.0° |
| H17 | C22 | N24 | H20 | 123.9° | 143.2° |
| H21 | C27 | N28 | H22 | 20.4° | 40.2° |
| H21 | C27 | C31 | H27 | 93.1° | 146.1° |
| H21 | C27 | C31 | H28 | 28.2° | 23.8° |
| H22 | N28 | C29 | H24 | 5.9° | 40.2° |
| H22 | N28 | C29 | H25 | 126.4° | 82.2° |
| H24 | C29 | C30 | H26 | 10.5° | 24.1° |
| H25 | C29 | C30 | H26 | 110.0° | 98.4° |
| H26 | C30 | C31 | H27 | 97.9° | 122.2° |
| H26 | C30 | C31 | H28 | 23.5° | 0.0° |
| H29 | C35 | C36 | H30 | 1.9° | 0.0° |
| H29 | C35 | C36 | H31 | 142.9° | 145.0° |
| H29 | C35 | C37 | H32 | 142.8° | 145.0° |
| H29 | C35 | C37 | H33 | 1.7° | 0.0° |
| H30 | C36 | C37 | H32 | 141.1° | 145.0° |
| H30 | C36 | C37 | H33 | 0.1° | 0.0° |
| H31 | C36 | C37 | H32 | 0.1° | 0.0° |
| H31 | C36 | C37 | H33 | 141.1° | 145.0° |
| H35 | C20 | C24 | H37 | 64.3° | 56.8° |
| H35 | C20 | C24 | H38 | 55.8° | 176.9° |
| H36 | C20 | C24 | H37 | 55.0° | 63.2° |
| H36 | C20 | C24 | H38 | 175.1° | 56.9° |
| H39 | C28 | C32 | H41 | 65.7° | 63.3° |
| H39 | C28 | C32 | H42 | 53.6° | 56.8° |
| H40 | C28 | C32 | H41 | 54.1° | 56.9° |
| H40 | C28 | C32 | H42 | 173.4° | 177.0° |
