ZBD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O31 | S5 | doub | 1.42Å | 1.42Å | |
| O3 | C2 | doub | 1.21Å | 1.22Å | |
| O17 | C14 | sing | 1.43Å | 1.43Å | |
| F19 | C16 | sing | 1.40Å | 1.40Å | |
| C34 | C2 | sing | 1.51Å | 1.51Å | |
| C34 | C33 | sing | 1.53Å | 1.52Å | |
| C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| O30 | S5 | doub | 1.42Å | 1.43Å | |
| C2 | N4 | sing | 1.35Å | 1.35Å | |
| C13 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| S5 | N6 | sing | 1.67Å | 1.67Å | |
| S5 | N1 | sing | 1.67Å | 1.67Å | |
| F18 | C16 | sing | 1.40Å | 1.40Å | |
| C33 | C32 | sing | 1.53Å | 1.53Å | |
| C16 | C14 | sing | 1.53Å | 1.54Å | |
| C16 | F20 | sing | 1.40Å | 1.39Å | |
| C32 | N6 | sing | 1.47Å | 1.46Å | |
| N4 | C37 | sing | 1.47Å | 1.47Å | |
| N4 | C39 | sing | 1.46Å | 1.46Å | |
| C14 | C11 | sing | 1.51Å | 1.52Å | |
| C14 | C15 | sing | 1.53Å | 1.54Å | |
| C35 | C37 | sing | 1.53Å | 1.55Å | |
| C35 | C38 | sing | 1.53Å | 1.54Å | |
| C11 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C37 | C40 | sing | 1.53Å | 1.53Å | |
| N6 | C25 | sing | 1.41Å | 1.41Å | |
| C8 | C7 | sing | 1.51Å | 1.51Å | |
| C8 | C9 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | N1 | sing | 1.47Å | 1.47Å | |
| F22 | C15 | sing | 1.40Å | 1.40Å | |
| N1 | C24 | sing | 1.41Å | 1.41Å | |
| C15 | F23 | sing | 1.40Å | 1.40Å | |
| C15 | F21 | sing | 1.40Å | 1.40Å | |
| C10 | C9 | sing | 1.38Å | 1.38Å | Aromatic |
| C38 | O36 | sing | 1.43Å | 1.43Å | |
| C25 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C25 | C26 | sing | 1.40Å | 1.40Å | Aromatic |
| C24 | C29 | sing | 1.40Å | 1.40Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C7 | H1 | sing | 1.09Å | 1.10Å | |
| C7 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.08Å | 1.08Å | |
| C13 | H4 | sing | 1.08Å | 1.08Å | |
| C26 | H5 | sing | 1.08Å | 1.08Å | |
| C28 | H6 | sing | 1.08Å | 1.08Å | |
| C32 | H7 | sing | 1.09Å | 1.10Å | |
| C32 | H8 | sing | 1.09Å | 1.10Å | |
| C33 | H9 | sing | 1.09Å | 1.10Å | |
| C33 | H10 | sing | 1.09Å | 1.10Å | |
| C34 | H11 | sing | 1.09Å | 1.10Å | |
| C34 | H12 | sing | 1.09Å | 1.10Å | |
| C39 | H13 | sing | 1.09Å | 1.10Å | |
| C39 | H14 | sing | 1.09Å | 1.10Å | |
| C39 | H15 | sing | 1.09Å | 1.10Å | |
| C37 | H16 | sing | 1.09Å | 1.10Å | |
| C40 | H17 | sing | 1.09Å | 1.10Å | |
| C40 | H18 | sing | 1.09Å | 1.10Å | |
| C40 | H19 | sing | 1.09Å | 1.10Å | |
| C35 | H20 | sing | 1.09Å | 1.10Å | |
| C35 | H21 | sing | 1.09Å | 1.10Å | |
| C38 | H22 | sing | 1.09Å | 1.10Å | |
| C38 | H23 | sing | 1.09Å | 1.10Å | |
| O36 | H24 | sing | 0.97Å | 0.95Å | |
| C27 | H25 | sing | 1.08Å | 1.08Å | |
| C29 | H26 | sing | 1.08Å | 1.08Å | |
| C12 | H27 | sing | 1.08Å | 1.08Å | |
| C9 | H28 | sing | 1.08Å | 1.08Å | |
| O17 | H29 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O31 | S5 | O30 | 123.5° | 124.2° |
| O31 | S5 | N6 | 106.8° | 107.4° |
| O31 | S5 | N1 | 108.3° | 107.5° |
| O3 | C2 | C34 | 121.1° | 120.0° |
| O3 | C2 | N4 | 119.9° | 120.1° |
| O17 | C14 | C16 | 109.1° | 109.5° |
| O17 | C14 | C11 | 107.4° | 109.4° |
| O17 | C14 | C15 | 107.8° | 109.5° |
| C14 | O17 | H29 | 109.5° | 114.0° |
| F19 | C16 | F18 | 108.1° | 109.4° |
| F19 | C16 | C14 | 109.5° | 109.5° |
| F19 | C16 | F20 | 108.7° | 109.5° |
| C2 | C34 | C33 | 110.2° | 109.5° |
| C34 | C2 | N4 | 119.0° | 120.0° |
| C2 | C34 | H11 | 109.3° | 109.4° |
| C2 | C34 | H12 | 109.3° | 109.5° |
| C34 | C33 | C32 | 109.1° | 109.5° |
| C34 | C33 | H9 | 109.6° | 109.5° |
| C34 | C33 | H10 | 109.6° | 109.5° |
| C33 | C34 | H11 | 109.3° | 109.5° |
| C33 | C34 | H12 | 109.3° | 109.5° |
| C13 | C12 | C11 | 120.5° | 120.0° |
| C12 | C13 | C8 | 120.0° | 120.0° |
| C12 | C13 | H4 | 120.0° | 120.0° |
| C13 | C12 | H27 | 119.7° | 120.0° |
| C12 | C11 | C14 | 119.4° | 120.0° |
| C12 | C11 | C10 | 119.0° | 120.0° |
| C11 | C12 | H27 | 119.8° | 120.0° |
| O30 | S5 | N6 | 107.8° | 107.4° |
| O30 | S5 | N1 | 107.8° | 107.4° |
| C2 | N4 | C37 | 119.6° | 119.9° |
| C2 | N4 | C39 | 118.6° | 120.0° |
| C13 | C8 | C7 | 119.5° | 120.0° |
| C13 | C8 | C9 | 120.1° | 120.0° |
| C8 | C13 | H4 | 120.0° | 120.0° |
| N6 | S5 | N1 | 100.3° | 100.4° |
| S5 | N6 | C32 | 127.3° | 127.5° |
| S5 | N6 | C25 | 105.3° | 105.1° |
| S5 | N1 | C7 | 128.2° | 127.4° |
| S5 | N1 | C24 | 105.1° | 105.1° |
| F18 | C16 | C14 | 110.8° | 109.5° |
| F18 | C16 | F20 | 108.6° | 109.5° |
| C33 | C32 | N6 | 107.8° | 109.4° |
| C33 | C32 | H7 | 109.9° | 109.5° |
| C33 | C32 | H8 | 109.9° | 109.5° |
| C32 | C33 | H9 | 109.6° | 109.5° |
| C32 | C33 | H10 | 109.6° | 109.5° |
| C14 | C16 | F20 | 111.1° | 109.5° |
| C16 | C14 | C11 | 111.1° | 109.4° |
| C16 | C14 | C15 | 110.0° | 109.5° |
| C32 | N6 | C25 | 127.4° | 127.4° |
| N6 | C32 | H7 | 109.9° | 109.5° |
| N6 | C32 | H8 | 109.9° | 109.5° |
| C37 | N4 | C39 | 121.9° | 120.0° |
| N4 | C37 | C35 | 111.6° | 109.5° |
| N4 | C37 | C40 | 109.3° | 109.4° |
| N4 | C37 | H16 | 107.8° | 109.5° |
| N4 | C39 | H13 | 109.5° | 109.4° |
| N4 | C39 | H14 | 109.5° | 109.4° |
| N4 | C39 | H15 | 109.5° | 109.5° |
| C11 | C14 | C15 | 111.4° | 109.5° |
| C14 | C11 | C10 | 121.6° | 120.0° |
| C14 | C15 | F22 | 108.2° | 109.5° |
| C14 | C15 | F23 | 111.3° | 109.5° |
| C14 | C15 | F21 | 111.5° | 109.4° |
| C37 | C35 | C38 | 114.9° | 109.4° |
| C35 | C37 | C40 | 113.8° | 109.5° |
| C35 | C37 | H16 | 107.0° | 109.5° |
| C37 | C35 | H20 | 108.1° | 109.5° |
| C37 | C35 | H21 | 108.1° | 109.5° |
| C35 | C38 | O36 | 111.2° | 109.5° |
| C38 | C35 | H20 | 108.1° | 109.5° |
| C38 | C35 | H21 | 108.1° | 109.4° |
| C35 | C38 | H22 | 109.0° | 109.5° |
| C35 | C38 | H23 | 109.0° | 109.5° |
| C11 | C10 | C9 | 120.9° | 120.0° |
| C11 | C10 | H3 | 119.6° | 120.0° |
| C40 | C37 | H16 | 107.2° | 109.4° |
| C37 | C40 | H17 | 109.5° | 109.4° |
| C37 | C40 | H18 | 109.5° | 109.5° |
| C37 | C40 | H19 | 109.5° | 109.5° |
| N6 | C25 | C24 | 114.6° | 114.7° |
| N6 | C25 | C26 | 126.1° | 126.0° |
| C7 | C8 | C9 | 120.4° | 120.0° |
| C8 | C7 | N1 | 110.6° | 109.5° |
| C8 | C7 | H1 | 109.2° | 109.4° |
| C8 | C7 | H2 | 109.2° | 109.5° |
| C8 | C9 | C10 | 119.6° | 120.0° |
| C8 | C9 | H28 | 120.2° | 120.0° |
| C7 | N1 | C24 | 126.7° | 127.4° |
| N1 | C7 | H1 | 109.2° | 109.4° |
| N1 | C7 | H2 | 109.2° | 109.5° |
| F22 | C15 | F23 | 108.5° | 109.5° |
| F22 | C15 | F21 | 108.5° | 109.5° |
| N1 | C24 | C25 | 114.8° | 114.6° |
| N1 | C24 | C29 | 125.9° | 126.0° |
| F23 | C15 | F21 | 108.7° | 109.5° |
| C9 | C10 | H3 | 119.6° | 120.0° |
| C10 | C9 | H28 | 120.2° | 120.0° |
| O36 | C38 | H22 | 109.1° | 109.5° |
| O36 | C38 | H23 | 109.0° | 109.4° |
| C38 | O36 | H24 | 109.5° | 114.0° |
| C24 | C25 | C26 | 119.3° | 119.4° |
| C25 | C24 | C29 | 119.3° | 119.4° |
| C25 | C26 | C27 | 120.8° | 120.7° |
| C25 | C26 | H5 | 119.6° | 119.7° |
| C24 | C29 | C28 | 121.0° | 120.7° |
| C24 | C29 | H26 | 119.5° | 119.7° |
| C26 | C27 | C28 | 119.8° | 119.9° |
| C27 | C26 | H5 | 119.6° | 119.6° |
| C26 | C27 | H25 | 120.1° | 120.1° |
| C29 | C28 | C27 | 119.8° | 119.9° |
| C29 | C28 | H6 | 120.1° | 120.1° |
| C28 | C29 | H26 | 119.5° | 119.6° |
| C27 | C28 | H6 | 120.1° | 120.0° |
| C28 | C27 | H25 | 120.1° | 120.0° |
| H1 | C7 | H2 | 109.5° | 109.5° |
| H7 | C32 | H8 | 109.5° | 109.5° |
| H9 | C33 | H10 | 109.4° | 109.5° |
| H11 | C34 | H12 | 109.4° | 109.5° |
| H13 | C39 | H14 | 109.5° | 109.5° |
| H13 | C39 | H15 | 109.4° | 109.4° |
| H14 | C39 | H15 | 109.5° | 109.5° |
| H17 | C40 | H18 | 109.5° | 109.4° |
| H17 | C40 | H19 | 109.5° | 109.5° |
| H18 | C40 | H19 | 109.4° | 109.5° |
| H20 | C35 | H21 | 109.4° | 109.5° |
| H22 | C38 | H23 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O31 | S5 | O30 | N6 | 125.1° | 126.4° |
| O31 | S5 | O30 | N1 | 127.4° | 126.3° |
| O31 | S5 | N6 | N1 | 112.9° | 112.2° |
| O31 | S5 | N6 | C32 | 67.1° | 67.9° |
| O31 | S5 | N6 | C25 | 113.2° | 111.9° |
| O31 | S5 | N1 | C7 | 68.5° | 68.1° |
| O31 | S5 | N1 | C24 | 112.0° | 112.2° |
| O3 | C2 | C34 | N4 | 179.7° | 179.9° |
| O3 | C2 | C34 | C33 | 67.6° | 0.0° |
| O3 | C2 | N4 | C37 | 0.5° | 0.0° |
| O3 | C2 | N4 | C39 | 179.9° | 180.0° |
| O3 | C2 | C34 | H11 | 172.3° | 120.0° |
| O3 | C2 | C34 | H12 | 52.5° | 120.0° |
| O17 | C14 | C16 | F19 | 20.6° | 60.1° |
| O17 | C14 | C11 | C12 | 28.9° | 179.2° |
| O17 | C14 | C16 | F18 | 98.6° | 180.0° |
| O17 | C14 | C16 | C11 | 118.2° | 119.9° |
| O17 | C14 | C16 | C15 | 118.0° | 120.0° |
| O17 | C14 | C16 | F20 | 140.6° | 60.0° |
| O17 | C14 | C11 | C15 | 117.8° | 120.0° |
| O17 | C14 | C11 | C10 | 149.9° | 0.8° |
| O17 | C14 | C15 | F22 | 50.0° | 65.2° |
| O17 | C14 | C15 | F23 | 69.1° | 174.8° |
| O17 | C14 | C15 | F21 | 169.3° | 54.8° |
| F19 | C16 | F18 | C14 | 120.0° | 120.0° |
| F19 | C16 | F18 | F20 | 117.8° | 120.0° |
| F19 | C16 | C14 | F20 | 120.0° | 120.0° |
| F19 | C16 | C14 | C11 | 138.8° | 180.0° |
| F19 | C16 | C14 | C15 | 97.5° | 60.0° |
| C2 | C34 | C33 | H11 | 120.1° | 119.9° |
| C2 | C34 | C33 | H12 | 120.1° | 120.0° |
| C2 | C34 | C33 | C32 | 152.4° | 179.9° |
| C34 | C2 | N4 | C37 | 179.2° | 180.0° |
| C34 | C2 | N4 | C39 | 0.2° | 0.1° |
| C2 | C34 | C33 | H9 | 87.7° | 60.1° |
| C2 | C34 | C33 | H10 | 32.4° | 60.0° |
| C2 | C34 | H11 | H12 | 119.7° | 120.1° |
| C33 | C34 | C2 | N4 | 112.7° | 180.0° |
| C34 | C33 | C32 | H9 | 120.0° | 120.0° |
| C34 | C33 | C32 | H10 | 120.0° | 120.0° |
| C34 | C33 | C32 | N6 | 175.4° | 180.0° |
| C34 | C33 | C32 | H7 | 64.9° | 60.0° |
| C34 | C33 | C32 | H8 | 55.6° | 60.0° |
| C34 | C33 | H9 | H10 | 120.2° | 120.0° |
| C33 | C34 | H11 | H12 | 119.7° | 120.0° |
| C13 | C12 | C11 | H27 | 180.0° | 180.0° |
| C12 | C13 | C8 | H4 | 180.0° | 179.9° |
| C13 | C12 | C11 | C14 | 179.6° | 180.0° |
| C13 | C12 | C11 | C10 | 0.7° | 0.0° |
| C12 | C13 | C8 | C7 | 179.9° | 180.0° |
| C12 | C13 | C8 | C9 | 0.2° | 0.4° |
| C11 | C12 | C13 | C8 | 0.5° | 0.1° |
| C12 | C11 | C14 | C16 | 90.3° | 60.9° |
| C12 | C11 | C14 | C10 | 178.8° | 180.0° |
| C12 | C11 | C14 | C15 | 146.7° | 59.2° |
| C12 | C11 | C10 | C9 | 0.7° | 0.2° |
| C12 | C11 | C10 | H3 | 179.3° | 179.7° |
| C11 | C12 | C13 | H4 | 179.5° | 180.0° |
| O30 | S5 | N6 | N1 | 112.6° | 112.1° |
| O30 | S5 | N6 | C32 | 67.5° | 67.9° |
| O30 | S5 | N6 | C25 | 112.2° | 112.3° |
| O30 | S5 | N1 | C7 | 67.2° | 67.6° |
| O30 | S5 | N1 | C24 | 112.3° | 112.1° |
| C2 | N4 | C37 | C39 | 179.4° | 180.0° |
| C2 | N4 | C37 | C35 | 139.0° | 120.0° |
| C2 | N4 | C37 | C40 | 94.3° | 120.0° |
| N4 | C2 | C34 | H11 | 7.4° | 60.1° |
| N4 | C2 | C34 | H12 | 127.1° | 60.0° |
| C2 | N4 | C39 | H13 | 180.0° | 90.0° |
| C2 | N4 | C39 | H14 | 60.0° | 150.0° |
| C2 | N4 | C39 | H15 | 60.0° | 30.0° |
| C2 | N4 | C37 | H16 | 21.9° | 0.1° |
| C13 | C8 | C7 | C9 | 179.7° | 179.7° |
| C13 | C8 | C7 | N1 | 90.8° | 89.7° |
| C13 | C8 | C9 | C10 | 0.1° | 0.5° |
| C13 | C8 | C7 | H1 | 29.3° | 150.3° |
| C13 | C8 | C7 | H2 | 149.0° | 30.3° |
| C8 | C13 | C12 | H27 | 179.5° | 179.9° |
| C13 | C8 | C9 | H28 | 179.9° | 179.7° |
| S5 | N6 | C32 | C33 | 71.4° | 95.0° |
| S5 | N6 | C32 | C25 | 179.6° | 179.8° |
| N6 | S5 | N1 | C7 | 179.8° | 179.7° |
| N6 | S5 | N1 | C24 | 0.3° | 0.0° |
| S5 | N6 | C25 | C24 | 0.3° | 0.4° |
| S5 | N6 | C25 | C26 | 178.0° | 180.0° |
| S5 | N6 | C32 | H7 | 168.8° | 145.0° |
| S5 | N6 | C32 | H8 | 48.3° | 25.0° |
| N1 | S5 | N6 | C32 | 180.0° | 179.9° |
| N1 | S5 | N6 | C25 | 0.3° | 0.2° |
| S5 | N1 | C7 | C8 | 73.7° | 95.2° |
| S5 | N1 | C7 | C24 | 179.4° | 179.7° |
| S5 | N1 | C24 | C25 | 0.2° | 0.3° |
| S5 | N1 | C24 | C29 | 179.1° | 179.8° |
| S5 | N1 | C7 | H1 | 46.5° | 24.7° |
| S5 | N1 | C7 | H2 | 166.2° | 144.7° |
| F18 | C16 | C14 | F20 | 120.8° | 120.0° |
| F18 | C16 | C14 | C11 | 19.6° | 60.1° |
| F18 | C16 | C14 | C15 | 143.4° | 60.0° |
| C33 | C32 | N6 | H7 | 119.7° | 120.0° |
| C33 | C32 | N6 | H8 | 119.8° | 120.0° |
| C33 | C32 | N6 | C25 | 108.2° | 84.8° |
| C33 | C32 | H7 | H8 | 120.8° | 120.0° |
| C32 | C33 | H9 | H10 | 120.2° | 120.0° |
| C32 | C33 | C34 | H11 | 32.3° | 60.0° |
| C32 | C33 | C34 | H12 | 87.5° | 60.0° |
| C16 | C14 | C11 | C15 | 122.9° | 120.0° |
| C16 | C14 | C11 | C10 | 90.8° | 119.2° |
| C16 | C14 | C15 | F22 | 68.8° | 174.8° |
| C16 | C14 | C15 | F23 | 172.1° | 54.8° |
| C16 | C14 | C15 | F21 | 50.4° | 65.2° |
| C16 | C14 | O17 | H29 | 180.0° | 60.0° |
| F20 | C16 | C14 | C11 | 101.2° | 60.0° |
| F20 | C16 | C14 | C15 | 22.6° | 180.0° |
| C32 | N6 | C25 | C24 | 180.0° | 179.8° |
| C32 | N6 | C25 | C26 | 1.7° | 0.2° |
| N6 | C32 | H7 | H8 | 120.8° | 120.0° |
| N6 | C32 | C33 | H9 | 55.4° | 59.9° |
| N6 | C32 | C33 | H10 | 64.7° | 60.0° |
| N4 | C37 | C35 | C40 | 124.2° | 119.9° |
| N4 | C37 | C35 | H16 | 117.7° | 120.1° |
| N4 | C37 | C35 | C38 | 92.8° | 65.1° |
| N4 | C37 | C40 | H16 | 116.6° | 120.0° |
| C37 | N4 | C39 | H13 | 0.6° | 90.0° |
| C37 | N4 | C39 | H14 | 119.4° | 30.0° |
| C37 | N4 | C39 | H15 | 120.5° | 150.0° |
| N4 | C37 | C40 | H17 | 180.0° | 179.9° |
| N4 | C37 | C40 | H18 | 60.0° | 60.0° |
| N4 | C37 | C40 | H19 | 60.0° | 60.0° |
| N4 | C37 | C35 | H20 | 146.4° | 54.9° |
| N4 | C37 | C35 | H21 | 28.0° | 175.0° |
| C39 | N4 | C37 | C35 | 40.4° | 59.9° |
| C39 | N4 | C37 | C40 | 86.3° | 60.0° |
| N4 | C39 | H13 | H14 | 120.0° | 120.0° |
| N4 | C39 | H13 | H15 | 120.0° | 120.0° |
| N4 | C39 | H14 | H15 | 120.0° | 120.0° |
| C39 | N4 | C37 | H16 | 157.6° | 180.0° |
| C11 | C14 | C15 | F22 | 167.6° | 54.8° |
| C11 | C14 | C15 | F23 | 48.5° | 65.2° |
| C11 | C14 | C15 | F21 | 73.2° | 174.8° |
| C14 | C11 | C10 | C9 | 179.5° | 179.8° |
| C14 | C11 | C10 | H3 | 0.5° | 0.3° |
| C14 | C11 | C12 | H27 | 0.4° | 0.0° |
| C11 | C14 | O17 | H29 | 59.5° | 60.0° |
| C15 | C14 | C11 | C10 | 32.1° | 120.8° |
| C14 | C15 | F22 | F23 | 120.9° | 120.0° |
| C14 | C15 | F22 | F21 | 121.1° | 120.0° |
| C14 | C15 | F23 | F21 | 123.3° | 120.0° |
| C15 | C14 | O17 | H29 | 60.6° | 180.0° |
| C37 | C35 | C38 | H20 | 120.8° | 120.0° |
| C37 | C35 | C38 | H21 | 120.8° | 120.0° |
| C35 | C37 | C40 | H16 | 118.0° | 120.0° |
| C37 | C35 | C38 | O36 | 104.5° | 180.0° |
| C35 | C37 | C40 | H17 | 54.6° | 60.0° |
| C35 | C37 | C40 | H18 | 65.4° | 60.0° |
| C35 | C37 | C40 | H19 | 174.6° | 180.0° |
| C37 | C35 | H20 | H21 | 117.6° | 120.1° |
| C37 | C35 | C38 | H22 | 15.7° | 60.0° |
| C37 | C35 | C38 | H23 | 135.2° | 60.0° |
| C38 | C35 | C37 | C40 | 31.4° | 175.0° |
| C35 | C38 | O36 | H22 | 120.3° | 120.0° |
| C35 | C38 | O36 | H23 | 120.3° | 120.0° |
| C38 | C35 | C37 | H16 | 149.5° | 55.0° |
| C38 | C35 | H20 | H21 | 117.5° | 120.0° |
| C35 | C38 | H22 | H23 | 119.2° | 120.0° |
| C35 | C38 | O36 | H24 | 180.0° | 180.0° |
| C11 | C10 | C9 | C8 | 0.3° | 0.5° |
| C11 | C10 | C9 | H3 | 180.0° | 179.5° |
| C10 | C11 | C12 | H27 | 179.2° | 180.0° |
| C11 | C10 | C9 | H28 | 179.6° | 179.8° |
| C37 | C40 | H17 | H18 | 120.0° | 120.0° |
| C37 | C40 | H17 | H19 | 120.0° | 120.1° |
| C37 | C40 | H18 | H19 | 120.0° | 120.1° |
| C40 | C37 | C35 | H20 | 89.4° | 65.0° |
| C40 | C37 | C35 | H21 | 152.2° | 55.0° |
| N6 | C25 | C24 | N1 | 0.1° | 0.5° |
| N6 | C25 | C24 | C26 | 178.4° | 179.6° |
| N6 | C25 | C24 | C29 | 179.4° | 179.6° |
| N6 | C25 | C26 | C27 | 178.8° | 179.5° |
| N6 | C25 | C26 | H5 | 1.2° | 0.5° |
| C25 | N6 | C32 | H7 | 11.5° | 35.2° |
| C25 | N6 | C32 | H8 | 132.0° | 155.2° |
| C8 | C7 | N1 | H1 | 120.2° | 119.9° |
| C8 | C7 | N1 | H2 | 120.2° | 120.0° |
| C8 | C7 | N1 | C24 | 105.8° | 85.1° |
| C7 | C8 | C9 | C10 | 179.8° | 179.8° |
| C8 | C7 | H1 | H2 | 119.5° | 120.0° |
| C7 | C8 | C13 | H4 | 0.1° | 0.1° |
| C7 | C8 | C9 | H28 | 0.2° | 0.0° |
| C9 | C8 | C7 | N1 | 89.5° | 90.0° |
| C8 | C9 | C10 | H28 | 180.0° | 179.8° |
| C9 | C8 | C7 | H1 | 150.3° | 30.0° |
| C9 | C8 | C7 | H2 | 30.7° | 150.0° |
| C8 | C9 | C10 | H3 | 179.7° | 180.0° |
| C9 | C8 | C13 | H4 | 179.8° | 179.8° |
| C7 | N1 | C24 | C25 | 179.7° | 180.0° |
| C7 | N1 | C24 | C29 | 0.4° | 0.0° |
| N1 | C7 | H1 | H2 | 119.5° | 120.0° |
| F22 | C15 | F23 | F21 | 117.8° | 120.0° |
| N1 | C24 | C25 | C29 | 179.4° | 180.0° |
| N1 | C24 | C25 | C26 | 178.3° | 180.0° |
| N1 | C24 | C29 | C28 | 179.3° | 179.9° |
| C24 | N1 | C7 | H1 | 134.1° | 155.0° |
| C24 | N1 | C7 | H2 | 14.4° | 35.0° |
| N1 | C24 | C29 | H26 | 0.6° | 0.0° |
| O36 | C38 | C35 | H20 | 134.6° | 60.0° |
| O36 | C38 | C35 | H21 | 16.3° | 60.0° |
| O36 | C38 | H22 | H23 | 119.2° | 120.0° |
| C24 | C25 | C26 | C27 | 0.6° | 0.0° |
| C25 | C24 | C29 | C28 | 0.1° | 0.0° |
| C24 | C25 | C26 | H5 | 179.4° | 180.0° |
| C25 | C24 | C29 | H26 | 179.9° | 179.9° |
| C26 | C25 | C24 | C29 | 1.0° | 0.0° |
| C25 | C26 | C27 | H5 | 180.0° | 180.0° |
| C25 | C26 | C27 | C28 | 1.0° | 0.1° |
| C25 | C26 | C27 | H25 | 179.0° | 180.0° |
| C24 | C29 | C28 | H26 | 180.0° | 179.9° |
| C24 | C29 | C28 | C27 | 1.6° | 0.1° |
| C24 | C29 | C28 | H6 | 178.4° | 180.0° |
| C26 | C27 | C28 | C29 | 2.0° | 0.1° |
| C26 | C27 | C28 | H25 | 180.0° | 180.0° |
| C26 | C27 | C28 | H6 | 177.9° | 180.0° |
| C29 | C28 | C27 | H6 | 180.0° | 180.0° |
| C29 | C28 | C27 | H25 | 177.9° | 179.9° |
| C28 | C27 | C26 | H5 | 179.0° | 180.0° |
| C27 | C28 | C29 | H26 | 178.4° | 180.0° |
| H3 | C10 | C9 | H28 | 0.4° | 0.2° |
| H4 | C13 | C12 | H27 | 0.5° | 0.0° |
| H5 | C26 | C27 | H25 | 1.0° | 0.0° |
| H6 | C28 | C27 | H25 | 2.1° | 0.0° |
| H6 | C28 | C29 | H26 | 1.7° | 0.1° |
| H7 | C32 | C33 | H9 | 175.1° | 180.0° |
| H7 | C32 | C33 | H10 | 55.1° | 60.0° |
| H8 | C32 | C33 | H9 | 64.3° | 60.0° |
| H8 | C32 | C33 | H10 | 175.6° | 180.0° |
| H9 | C33 | C34 | H11 | 152.2° | 180.0° |
| H9 | C33 | C34 | H12 | 32.4° | 60.0° |
| H10 | C33 | C34 | H11 | 87.7° | 60.0° |
| H10 | C33 | C34 | H12 | 152.5° | 180.0° |
| H13 | C39 | H14 | H15 | 120.0° | 120.0° |
| H16 | C37 | C40 | H17 | 63.4° | 60.1° |
| H16 | C37 | C40 | H18 | 176.5° | 180.0° |
| H16 | C37 | C40 | H19 | 56.6° | 60.0° |
| H16 | C37 | C35 | H20 | 28.7° | 175.0° |
| H16 | C37 | C35 | H21 | 89.7° | 64.9° |
| H17 | C40 | H18 | H19 | 120.0° | 120.0° |
| H20 | C35 | C38 | H22 | 105.1° | 180.0° |
| H20 | C35 | C38 | H23 | 14.3° | 60.0° |
| H21 | C35 | C38 | H22 | 136.6° | 60.0° |
| H21 | C35 | C38 | H23 | 104.0° | 180.0° |
| H22 | C38 | O36 | H24 | 59.7° | 59.9° |
| H23 | C38 | O36 | H24 | 59.7° | 60.0° |
