424
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| S1 | C4 | sing | 1.81Å | 1.82Å | |
| S1 | C7 | sing | 1.76Å | 1.78Å | |
| S1 | O18 | doub | 1.42Å | 1.42Å | |
| S1 | O19 | doub | 1.42Å | 1.42Å | |
| N2 | C5 | sing | 1.35Å | 1.33Å | |
| N2 | C6 | sing | 1.47Å | 1.47Å | |
| N2 | C8 | sing | 1.47Å | 1.48Å | |
| CL2 | C23 | sing | 1.74Å | 1.71Å | |
| C3 | C5 | sing | 1.51Å | 1.51Å | |
| C3 | C11 | sing | 1.53Å | 1.54Å | |
| C3 | C12 | sing | 1.53Å | 1.54Å | |
| C3 | C17 | sing | 1.51Å | 1.53Å | |
| CL3 | C27 | sing | 1.74Å | 1.76Å | |
| C4 | C8 | sing | 1.55Å | 1.55Å | |
| C4 | C9 | sing | 1.55Å | 1.56Å | |
| C5 | O22 | doub | 1.21Å | 1.21Å | |
| C6 | C9 | sing | 1.54Å | 1.54Å | |
| C6 | C10 | sing | 1.51Å | 1.51Å | |
| C7 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | N14 | sing | 1.35Å | 1.34Å | |
| C10 | O24 | doub | 1.21Å | 1.21Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C13 | N14 | sing | 1.47Å | 1.46Å | |
| C13 | C15 | sing | 1.51Å | 1.47Å | |
| C13 | C20 | sing | 1.53Å | 1.54Å | |
| C13 | C21 | sing | 1.53Å | 1.53Å | |
| C15 | N16 | doub | 1.28Å | 1.30Å | |
| C17 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C20 | C21 | sing | 1.53Å | 1.54Å | |
| C23 | C33 | sing | 1.38Å | 1.37Å | Aromatic |
| C25 | C30 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C31 | doub | 1.38Å | 1.40Å | Aromatic |
| C27 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C27 | C31 | sing | 1.38Å | 1.40Å | Aromatic |
| C29 | C34 | doub | 1.38Å | 1.38Å | Aromatic |
| C33 | C35 | doub | 1.38Å | 1.38Å | Aromatic |
| C34 | C35 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| N14 | HN14 | sing | 0.97Å | 1.00Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| N16 | HN16 | sing | 0.97Å | 1.00Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C4 | S1 | C7 | 106.8° | 104.4° |
| C4 | S1 | O18 | 107.6° | 110.5° |
| C4 | S1 | O19 | 108.7° | 110.6° |
| S1 | C4 | C8 | 113.9° | 111.0° |
| S1 | C4 | C9 | 108.7° | 111.0° |
| S1 | C4 | H4 | 104.9° | 110.9° |
| C7 | S1 | O18 | 108.9° | 104.3° |
| C7 | S1 | O19 | 100.6° | 104.3° |
| S1 | C7 | C23 | 123.5° | 120.0° |
| S1 | C7 | C29 | 118.2° | 120.0° |
| O18 | S1 | O19 | 123.2° | 121.0° |
| C5 | N2 | C6 | 124.1° | 125.6° |
| C5 | N2 | C8 | 125.7° | 125.7° |
| N2 | C5 | C3 | 121.1° | 120.0° |
| N2 | C5 | O22 | 116.4° | 120.0° |
| C6 | N2 | C8 | 110.2° | 108.7° |
| N2 | C6 | C9 | 106.5° | 107.3° |
| N2 | C6 | C10 | 113.0° | 109.9° |
| N2 | C6 | H6 | 108.5° | 109.9° |
| N2 | C8 | C4 | 104.4° | 104.8° |
| N2 | C8 | H8 | 111.2° | 110.4° |
| N2 | C8 | H8A | 112.3° | 110.3° |
| CL2 | C23 | C7 | 120.6° | 120.0° |
| CL2 | C23 | C33 | 118.1° | 120.1° |
| C5 | C3 | C11 | 114.2° | 117.5° |
| C5 | C3 | C12 | 117.9° | 117.5° |
| C5 | C3 | C17 | 113.7° | 115.6° |
| C3 | C5 | O22 | 122.5° | 120.0° |
| C11 | C3 | C12 | 59.6° | 60.0° |
| C11 | C3 | C17 | 121.7° | 117.5° |
| C3 | C11 | C12 | 60.1° | 60.0° |
| C3 | C11 | H11 | 130.8° | 117.5° |
| C3 | C11 | H11A | 135.9° | 117.5° |
| C12 | C3 | C17 | 119.6° | 117.5° |
| C3 | C12 | C11 | 60.3° | 60.0° |
| C3 | C12 | H12 | 130.7° | 117.5° |
| C3 | C12 | H12A | 135.8° | 117.5° |
| C3 | C17 | C25 | 122.2° | 119.9° |
| C3 | C17 | C26 | 120.6° | 120.0° |
| CL3 | C27 | C30 | 120.6° | 120.0° |
| CL3 | C27 | C31 | 122.7° | 120.0° |
| C8 | C4 | C9 | 102.2° | 101.5° |
| C8 | C4 | H4 | 111.1° | 111.0° |
| C4 | C8 | H8 | 111.2° | 110.4° |
| C4 | C8 | H8A | 112.3° | 110.4° |
| C4 | C9 | C6 | 102.2° | 103.0° |
| C9 | C4 | H4 | 116.2° | 111.2° |
| C4 | C9 | H9 | 112.0° | 110.7° |
| C4 | C9 | H9A | 113.5° | 110.7° |
| C9 | C6 | C10 | 107.6° | 109.9° |
| C9 | C6 | H6 | 113.9° | 109.9° |
| C6 | C9 | H9 | 112.0° | 110.7° |
| C6 | C9 | H9A | 113.5° | 110.8° |
| C6 | C10 | N14 | 117.4° | 120.0° |
| C6 | C10 | O24 | 121.4° | 120.1° |
| C10 | C6 | H6 | 107.5° | 110.0° |
| C23 | C7 | C29 | 118.3° | 120.0° |
| C7 | C23 | C33 | 121.3° | 120.0° |
| C7 | C29 | C34 | 121.3° | 120.0° |
| C7 | C29 | H29 | 119.4° | 120.0° |
| N14 | C10 | O24 | 121.2° | 119.9° |
| C10 | N14 | C13 | 122.6° | 120.0° |
| C10 | N14 | HN14 | 118.7° | 120.0° |
| C12 | C11 | H11 | 130.9° | 117.5° |
| C12 | C11 | H11A | 135.9° | 117.5° |
| C11 | C12 | H12 | 130.7° | 117.5° |
| C11 | C12 | H12A | 135.8° | 117.4° |
| N14 | C13 | C15 | 110.4° | 115.6° |
| N14 | C13 | C20 | 121.7° | 117.5° |
| N14 | C13 | C21 | 116.9° | 117.5° |
| C13 | N14 | HN14 | 118.7° | 120.0° |
| C15 | C13 | C20 | 120.6° | 117.5° |
| C15 | C13 | C21 | 118.4° | 117.5° |
| C13 | C15 | N16 | 124.0° | 120.0° |
| C13 | C15 | H15 | 118.0° | 120.0° |
| C20 | C13 | C21 | 60.5° | 60.0° |
| C13 | C20 | C21 | 59.5° | 60.0° |
| C13 | C20 | H20 | 131.2° | 117.5° |
| C13 | C20 | H20A | 136.3° | 117.5° |
| C13 | C21 | C20 | 60.0° | 60.0° |
| C13 | C21 | H21 | 130.9° | 117.5° |
| C13 | C21 | H21A | 136.0° | 117.6° |
| N16 | C15 | H15 | 118.0° | 120.0° |
| C15 | N16 | HN16 | 110.1° | 120.0° |
| C25 | C17 | C26 | 117.2° | 120.1° |
| C17 | C25 | C30 | 121.8° | 120.0° |
| C17 | C25 | H25 | 119.1° | 120.0° |
| C17 | C26 | C31 | 120.9° | 120.0° |
| C17 | C26 | H26 | 119.5° | 120.0° |
| C21 | C20 | H20 | 131.2° | 117.5° |
| C21 | C20 | H20A | 136.3° | 117.5° |
| C20 | C21 | H21 | 130.9° | 117.5° |
| C20 | C21 | H21A | 136.0° | 117.5° |
| C23 | C33 | C35 | 120.1° | 120.0° |
| C23 | C33 | H33 | 119.9° | 119.9° |
| C25 | C30 | C27 | 121.7° | 120.0° |
| C30 | C25 | H25 | 119.1° | 120.0° |
| C25 | C30 | H30 | 119.2° | 120.0° |
| C26 | C31 | C27 | 121.8° | 120.0° |
| C31 | C26 | H26 | 119.6° | 120.0° |
| C26 | C31 | H31 | 119.1° | 120.0° |
| C30 | C27 | C31 | 116.7° | 120.0° |
| C27 | C30 | H30 | 119.2° | 120.0° |
| C27 | C31 | H31 | 119.1° | 120.0° |
| C29 | C34 | C35 | 119.7° | 120.0° |
| C34 | C29 | H29 | 119.3° | 120.0° |
| C29 | C34 | H34 | 120.2° | 120.0° |
| C33 | C35 | C34 | 119.3° | 120.0° |
| C35 | C33 | H33 | 119.9° | 120.0° |
| C33 | C35 | H35 | 120.4° | 120.0° |
| C35 | C34 | H34 | 120.1° | 120.0° |
| C34 | C35 | H35 | 120.3° | 119.9° |
| H8 | C8 | H8A | 105.6° | 110.4° |
| H9 | C9 | H9A | 104.0° | 110.7° |
| H11 | C11 | H11A | 74.8° | 115.5° |
| H12 | C12 | H12A | 75.0° | 115.6° |
| H20 | C20 | H20A | 74.3° | 115.5° |
| H21 | C21 | H21A | 74.7° | 115.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C4 | S1 | C7 | O18 | 115.8° | 116.1° |
| C4 | S1 | C7 | O19 | 113.4° | 116.1° |
| C4 | S1 | O18 | O19 | 127.5° | 131.5° |
| S1 | C4 | C8 | N2 | 83.1° | 155.1° |
| S1 | C4 | C8 | C9 | 117.1° | 118.0° |
| S1 | C4 | C8 | H4 | 118.3° | 123.8° |
| S1 | C4 | C9 | H4 | 118.0° | 123.9° |
| S1 | C4 | C9 | C6 | 83.5° | 153.5° |
| C4 | S1 | C7 | C23 | 70.0° | 75.7° |
| C4 | S1 | C7 | C29 | 109.2° | 104.0° |
| S1 | C4 | C8 | H8 | 36.9° | 36.2° |
| S1 | C4 | C8 | H8A | 155.0° | 86.1° |
| S1 | C4 | C9 | H9 | 36.5° | 35.2° |
| S1 | C4 | C9 | H9A | 153.9° | 88.1° |
| C7 | S1 | O18 | O19 | 117.2° | 116.8° |
| S1 | C7 | C23 | CL2 | 0.7° | 0.0° |
| C7 | S1 | C4 | C8 | 59.5° | 74.3° |
| C7 | S1 | C4 | C9 | 172.7° | 173.6° |
| S1 | C7 | C23 | C29 | 179.2° | 179.8° |
| S1 | C7 | C23 | C33 | 179.7° | 180.0° |
| S1 | C7 | C29 | C34 | 179.9° | 180.0° |
| C7 | S1 | C4 | H4 | 62.3° | 49.5° |
| S1 | C7 | C29 | H29 | 0.1° | 0.0° |
| O18 | S1 | C4 | C8 | 176.2° | 174.0° |
| O18 | S1 | C4 | C9 | 70.6° | 61.9° |
| O18 | S1 | C7 | C23 | 45.9° | 168.2° |
| O18 | S1 | C7 | C29 | 134.9° | 12.0° |
| O18 | S1 | C4 | H4 | 54.4° | 62.1° |
| O19 | S1 | C4 | C8 | 48.3° | 37.3° |
| O19 | S1 | C4 | C9 | 64.9° | 74.8° |
| O19 | S1 | C7 | C23 | 176.6° | 40.3° |
| O19 | S1 | C7 | C29 | 4.2° | 139.9° |
| O19 | S1 | C4 | H4 | 170.1° | 161.2° |
| C5 | N2 | C6 | C8 | 177.5° | 179.7° |
| N2 | C5 | C3 | O22 | 179.7° | 180.0° |
| N2 | C5 | C3 | C11 | 85.4° | 136.3° |
| N2 | C5 | C3 | C12 | 152.4° | 67.7° |
| N2 | C5 | C3 | C17 | 60.3° | 78.1° |
| C5 | N2 | C8 | C4 | 159.9° | 155.9° |
| C5 | N2 | C6 | C9 | 176.0° | 179.0° |
| C5 | N2 | C6 | C10 | 58.1° | 59.6° |
| C5 | N2 | C6 | H6 | 61.0° | 61.6° |
| C5 | N2 | C8 | H8 | 39.9° | 85.2° |
| C5 | N2 | C8 | H8A | 78.2° | 37.1° |
| C6 | N2 | C5 | C3 | 179.9° | 174.6° |
| C6 | N2 | C8 | C4 | 17.6° | 24.4° |
| N2 | C6 | C9 | C4 | 27.5° | 22.0° |
| C6 | N2 | C5 | O22 | 0.5° | 5.4° |
| N2 | C6 | C9 | C10 | 121.5° | 119.4° |
| N2 | C6 | C9 | H6 | 119.6° | 119.4° |
| N2 | C6 | C10 | H6 | 119.7° | 121.1° |
| N2 | C6 | C10 | N14 | 128.2° | 180.0° |
| N2 | C6 | C10 | O24 | 52.1° | 0.0° |
| C6 | N2 | C8 | H8 | 137.6° | 94.5° |
| C6 | N2 | C8 | H8A | 104.3° | 143.2° |
| N2 | C6 | C9 | H9 | 147.5° | 96.3° |
| N2 | C6 | C9 | H9A | 95.1° | 140.4° |
| C8 | N2 | C5 | C3 | 2.7° | 5.0° |
| N2 | C8 | C4 | H8 | 120.0° | 118.9° |
| N2 | C8 | C4 | H8A | 121.9° | 118.8° |
| N2 | C8 | C4 | C9 | 33.9° | 37.1° |
| C8 | N2 | C5 | O22 | 177.6° | 175.0° |
| C8 | N2 | C6 | C9 | 6.5° | 1.3° |
| C8 | N2 | C6 | C10 | 124.4° | 120.7° |
| N2 | C8 | C4 | H4 | 158.6° | 81.1° |
| C8 | N2 | C6 | H6 | 116.5° | 118.1° |
| N2 | C8 | H8 | H8A | 122.1° | 122.3° |
| CL2 | C23 | C7 | C33 | 179.6° | 180.0° |
| CL2 | C23 | C7 | C29 | 179.9° | 179.8° |
| CL2 | C23 | C33 | C35 | 179.7° | 180.0° |
| CL2 | C23 | C33 | H33 | 0.3° | 0.0° |
| C5 | C3 | C11 | C12 | 109.3° | 107.5° |
| C5 | C3 | C11 | C17 | 142.6° | 145.0° |
| C5 | C3 | C12 | C17 | 145.3° | 145.1° |
| C5 | C3 | C17 | C25 | 122.0° | 1.8° |
| C5 | C3 | C17 | C26 | 55.8° | 178.4° |
| C5 | C3 | C11 | H11 | 130.6° | 145.0° |
| C5 | C3 | C11 | H11A | 17.4° | 0.0° |
| C5 | C3 | C12 | H12 | 16.9° | 0.0° |
| C5 | C3 | C12 | H12A | 130.2° | 145.1° |
| C11 | C3 | C12 | C17 | 111.6° | 107.4° |
| C11 | C3 | C5 | O22 | 95.0° | 43.7° |
| C3 | C11 | C12 | H11 | 120.0° | 107.5° |
| C3 | C11 | C12 | H11A | 126.7° | 107.5° |
| C11 | C3 | C17 | C25 | 20.8° | 143.8° |
| C11 | C3 | C17 | C26 | 161.3° | 36.0° |
| C3 | C11 | H11 | H11A | 138.6° | 145.6° |
| C11 | C3 | C12 | H12 | 120.0° | 107.5° |
| C11 | C3 | C12 | H12A | 126.7° | 107.4° |
| C12 | C3 | C5 | O22 | 28.0° | 112.3° |
| C12 | C3 | C17 | C25 | 91.3° | 147.5° |
| C12 | C3 | C17 | C26 | 90.9° | 32.6° |
| C3 | C12 | H12 | H12A | 138.5° | 145.7° |
| C17 | C3 | C5 | O22 | 119.4° | 101.9° |
| C3 | C17 | C25 | C26 | 177.9° | 179.8° |
| C3 | C17 | C25 | C30 | 179.9° | 180.0° |
| C3 | C17 | C26 | C31 | 179.2° | 180.0° |
| C17 | C3 | C11 | H11 | 12.0° | 0.0° |
| C17 | C3 | C11 | H11A | 125.3° | 145.0° |
| C17 | C3 | C12 | H12 | 128.5° | 145.0° |
| C17 | C3 | C12 | H12A | 15.2° | 0.0° |
| C3 | C17 | C25 | H25 | 0.1° | 0.1° |
| C3 | C17 | C26 | H26 | 0.8° | 0.1° |
| CL3 | C27 | C30 | C25 | 178.5° | 180.0° |
| CL3 | C27 | C31 | C26 | 179.2° | 179.9° |
| CL3 | C27 | C30 | C31 | 179.7° | 179.7° |
| CL3 | C27 | C30 | H30 | 1.5° | 0.1° |
| CL3 | C27 | C31 | H31 | 0.8° | 0.0° |
| C8 | C4 | C9 | H4 | 121.2° | 118.1° |
| C8 | C4 | C9 | C6 | 37.2° | 35.5° |
| C4 | C8 | H8 | H8A | 122.1° | 122.3° |
| C8 | C4 | C9 | H9 | 157.3° | 82.9° |
| C8 | C4 | C9 | H9A | 85.3° | 153.9° |
| C4 | C9 | C6 | H9 | 120.0° | 118.4° |
| C4 | C9 | C6 | H9A | 122.6° | 118.4° |
| C4 | C9 | C6 | C10 | 148.9° | 97.4° |
| C4 | C9 | C6 | H6 | 92.1° | 141.4° |
| C9 | C4 | C8 | H8 | 153.9° | 81.8° |
| C9 | C4 | C8 | H8A | 88.0° | 155.9° |
| C4 | C9 | H9 | H9A | 123.0° | 123.2° |
| C9 | C6 | C10 | H6 | 123.0° | 121.2° |
| C9 | C6 | C10 | N14 | 114.5° | 62.2° |
| C9 | C6 | C10 | O24 | 65.2° | 117.8° |
| C6 | C9 | C4 | H4 | 158.4° | 82.6° |
| C6 | C9 | H9 | H9A | 122.9° | 123.2° |
| C6 | C10 | N14 | O24 | 179.7° | 180.0° |
| C6 | C10 | N14 | C13 | 177.4° | 180.0° |
| C10 | C6 | C9 | H9 | 91.0° | 144.3° |
| C10 | C6 | C9 | H9A | 26.3° | 21.0° |
| C6 | C10 | N14 | HN14 | 2.6° | 0.0° |
| C23 | C7 | C29 | C34 | 0.9° | 0.3° |
| C7 | C23 | C33 | C35 | 0.6° | 0.1° |
| C23 | C7 | C29 | H29 | 179.1° | 179.8° |
| C7 | C23 | C33 | H33 | 179.3° | 180.0° |
| C29 | C7 | C23 | C33 | 0.5° | 0.2° |
| C7 | C29 | C34 | H29 | 180.0° | 179.9° |
| C7 | C29 | C34 | C35 | 1.4° | 0.0° |
| C7 | C29 | C34 | H34 | 178.6° | 179.9° |
| C10 | N14 | C13 | HN14 | 180.0° | 180.0° |
| C10 | N14 | C13 | C15 | 100.7° | 34.4° |
| C10 | N14 | C13 | C20 | 49.5° | 179.9° |
| C10 | N14 | C13 | C21 | 119.9° | 111.3° |
| N14 | C10 | C6 | H6 | 8.5° | 59.0° |
| O24 | C10 | N14 | C13 | 2.3° | 0.0° |
| O24 | C10 | C6 | H6 | 171.8° | 121.1° |
| O24 | C10 | N14 | HN14 | 177.7° | 180.0° |
| C12 | C11 | H11 | H11A | 138.5° | 145.7° |
| C11 | C12 | H12 | H12A | 138.5° | 145.6° |
| N14 | C13 | C15 | C20 | 150.6° | 145.7° |
| N14 | C13 | C15 | C21 | 138.7° | 145.6° |
| N14 | C13 | C20 | C21 | 105.2° | 107.5° |
| N14 | C13 | C15 | N16 | 179.4° | 25.6° |
| N14 | C13 | C15 | H15 | 0.7° | 154.4° |
| N14 | C13 | C20 | H20 | 134.8° | 145.1° |
| N14 | C13 | C20 | H20A | 21.5° | 0.0° |
| N14 | C13 | C21 | H21 | 7.1° | 0.0° |
| N14 | C13 | C21 | H21A | 120.4° | 145.0° |
| C15 | C13 | C20 | C21 | 107.5° | 107.5° |
| C13 | C15 | N16 | H15 | 180.0° | 180.0° |
| C15 | C13 | N14 | HN14 | 79.3° | 145.6° |
| C13 | C15 | N16 | HN16 | 180.0° | 179.9° |
| C15 | C13 | C20 | H20 | 12.5° | 0.0° |
| C15 | C13 | C20 | H20A | 125.8° | 145.0° |
| C15 | C13 | C21 | H21 | 129.0° | 145.0° |
| C15 | C13 | C21 | H21A | 15.7° | 0.1° |
| C20 | C13 | C15 | N16 | 30.0° | 120.1° |
| C13 | C20 | C21 | H20 | 120.0° | 107.5° |
| C13 | C20 | C21 | H20A | 126.7° | 107.5° |
| C20 | C13 | N14 | HN14 | 130.5° | 0.1° |
| C20 | C13 | C15 | H15 | 150.0° | 59.9° |
| C13 | C20 | H20 | H20A | 138.8° | 145.7° |
| C20 | C13 | C21 | H21 | 120.0° | 107.5° |
| C20 | C13 | C21 | H21A | 126.7° | 107.5° |
| C21 | C13 | C15 | N16 | 40.7° | 171.2° |
| C21 | C13 | N14 | HN14 | 60.1° | 68.8° |
| C21 | C13 | C15 | H15 | 139.3° | 8.7° |
| C13 | C21 | H21 | H21A | 138.6° | 145.8° |
| C17 | C25 | C30 | H25 | 180.0° | 180.0° |
| C25 | C17 | C26 | C31 | 1.2° | 0.1° |
| C17 | C25 | C30 | C27 | 2.0° | 0.0° |
| C25 | C17 | C26 | H26 | 178.8° | 179.7° |
| C17 | C25 | C30 | H30 | 178.0° | 180.0° |
| C26 | C17 | C25 | C30 | 2.0° | 0.2° |
| C17 | C26 | C31 | H26 | 180.0° | 179.9° |
| C17 | C26 | C31 | C27 | 0.5° | 0.2° |
| C26 | C17 | C25 | H25 | 178.0° | 179.8° |
| C17 | C26 | C31 | H31 | 179.5° | 179.9° |
| C21 | C20 | H20 | H20A | 138.8° | 145.7° |
| C20 | C21 | H21 | H21A | 138.6° | 145.6° |
| C23 | C33 | C35 | H33 | 180.0° | 180.0° |
| C23 | C33 | C35 | C34 | 1.1° | 0.3° |
| C23 | C33 | C35 | H35 | 178.8° | 180.0° |
| C25 | C30 | C27 | H30 | 180.0° | 179.9° |
| C25 | C30 | C27 | C31 | 1.2° | 0.3° |
| C26 | C31 | C27 | C30 | 0.5° | 0.4° |
| C26 | C31 | C27 | H31 | 180.0° | 179.9° |
| C27 | C30 | C25 | H25 | 178.0° | 180.0° |
| C30 | C27 | C31 | H31 | 179.5° | 179.7° |
| C27 | C31 | C26 | H26 | 179.5° | 180.0° |
| C31 | C27 | C30 | H30 | 178.8° | 179.7° |
| C29 | C34 | C35 | C33 | 1.5° | 0.3° |
| C29 | C34 | C35 | H34 | 180.0° | 179.9° |
| C29 | C34 | C35 | H35 | 178.5° | 180.0° |
| C33 | C35 | C34 | H35 | 180.0° | 179.7° |
| C33 | C35 | C34 | H34 | 178.5° | 179.7° |
| C35 | C34 | C29 | H29 | 178.6° | 180.0° |
| C34 | C35 | C33 | H33 | 178.8° | 179.7° |
| H4 | C4 | C8 | H8 | 81.4° | 160.0° |
| H4 | C4 | C8 | H8A | 36.6° | 37.7° |
| H4 | C4 | C9 | H9 | 81.6° | 159.0° |
| H4 | C4 | C9 | H9A | 35.9° | 35.8° |
| H6 | C6 | C9 | H9 | 27.9° | 23.0° |
| H6 | C6 | C9 | H9A | 145.3° | 100.2° |
| H11 | C11 | C12 | H12 | 120.0° | 145.0° |
| H11 | C11 | C12 | H12A | 6.7° | 0.0° |
| H11A | C11 | C12 | H12 | 6.7° | 0.1° |
| H11A | C11 | C12 | H12A | 106.6° | 145.0° |
| H15 | C15 | N16 | HN16 | 0.1° | 0.1° |
| H20 | C20 | C21 | H21 | 120.0° | 145.0° |
| H20 | C20 | C21 | H21A | 6.7° | 0.0° |
| H20A | C20 | C21 | H21 | 6.7° | 0.0° |
| H20A | C20 | C21 | H21A | 106.6° | 144.9° |
| H25 | C25 | C30 | H30 | 2.0° | 0.1° |
| H26 | C26 | C31 | H31 | 0.5° | 0.1° |
| H29 | C29 | C34 | H34 | 1.4° | 0.1° |
| H33 | C33 | C35 | H35 | 1.2° | 0.1° |
| H34 | C34 | C35 | H35 | 1.5° | 0.0° |
