8NC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| S1 | N4 | sing | 1.66Å | 1.64Å | |
| S1 | O19 | doub | 1.42Å | 1.42Å | |
| S1 | O20 | doub | 1.42Å | 1.42Å | |
| S1 | C33 | sing | 1.81Å | 1.81Å | |
| C2 | C3 | sing | 1.55Å | 1.56Å | |
| C2 | C5 | sing | 1.51Å | 1.51Å | |
| C2 | C8 | sing | 1.54Å | 1.54Å | |
| C3 | C7 | sing | 1.51Å | 1.50Å | |
| C3 | C9 | sing | 1.55Å | 1.53Å | |
| N4 | C8 | sing | 1.47Å | 1.47Å | |
| N4 | C9 | sing | 1.47Å | 1.46Å | |
| C5 | N12 | sing | 1.35Å | 1.34Å | |
| C5 | O23 | doub | 1.21Å | 1.22Å | |
| N6 | C10 | sing | 1.35Å | 1.35Å | |
| N6 | C11 | sing | 1.40Å | 1.40Å | |
| N6 | C21 | sing | 1.36Å | 1.37Å | |
| C7 | N14 | sing | 1.35Å | 1.33Å | |
| C7 | O24 | doub | 1.21Å | 1.21Å | |
| C10 | C25 | sing | 1.40Å | 1.41Å | |
| C10 | O27 | doub | 1.22Å | 1.23Å | |
| C11 | C13 | sing | 1.39Å | 1.38Å | Aromatic |
| C11 | C28 | doub | 1.39Å | 1.39Å | Aromatic |
| N12 | C15 | sing | 1.40Å | 1.41Å | |
| C13 | C16 | doub | 1.38Å | 1.38Å | Aromatic |
| N14 | C22 | sing | 1.40Å | 1.39Å | |
| C15 | C16 | sing | 1.39Å | 1.38Å | Aromatic |
| C15 | C29 | doub | 1.39Å | 1.39Å | Aromatic |
| C16 | F34 | sing | 1.35Å | 1.35Å | |
| C17 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
| C17 | F35 | sing | 1.35Å | 1.37Å | |
| C18 | C22 | sing | 1.39Å | 1.40Å | Aromatic |
| C21 | C30 | doub | 1.35Å | 1.35Å | |
| C22 | C36 | doub | 1.39Å | 1.38Å | Aromatic |
| C25 | C31 | doub | 1.36Å | 1.36Å | |
| C26 | C32 | doub | 1.39Å | 1.39Å | Aromatic |
| C26 | O37 | sing | 1.36Å | 1.37Å | |
| C28 | C29 | sing | 1.38Å | 1.40Å | Aromatic |
| C30 | C31 | sing | 1.40Å | 1.40Å | |
| C32 | C36 | sing | 1.38Å | 1.38Å | Aromatic |
| O37 | C38 | sing | 1.43Å | 1.42Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C33 | H333 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H81C | sing | 1.09Å | 1.10Å | |
| C8 | H82C | sing | 1.09Å | 1.10Å | |
| C9 | H91C | sing | 1.09Å | 1.10Å | |
| C9 | H92C | sing | 1.09Å | 1.10Å | |
| N12 | H12 | sing | 0.97Å | 1.00Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| N14 | H14 | sing | 0.97Å | 1.00Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| C38 | H381 | sing | 1.09Å | 1.10Å | |
| C38 | H382 | sing | 1.09Å | 1.10Å | |
| C38 | H383 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N4 | S1 | O19 | 101.7° | 104.3° |
| N4 | S1 | O20 | 102.8° | 104.2° |
| N4 | S1 | C33 | 103.3° | 104.5° |
| S1 | N4 | C8 | 118.1° | 125.7° |
| S1 | N4 | C9 | 116.4° | 125.6° |
| O19 | S1 | O20 | 121.6° | 121.0° |
| O19 | S1 | C33 | 113.1° | 110.6° |
| O20 | S1 | C33 | 111.4° | 110.5° |
| S1 | C33 | H331 | 109.5° | 109.5° |
| S1 | C33 | H332 | 109.5° | 109.5° |
| S1 | C33 | H333 | 109.4° | 109.5° |
| C3 | C2 | C5 | 111.7° | 110.7° |
| C3 | C2 | C8 | 102.5° | 103.0° |
| C2 | C3 | C7 | 108.4° | 111.0° |
| C2 | C3 | C9 | 105.2° | 101.6° |
| C3 | C2 | H2 | 113.6° | 110.7° |
| C2 | C3 | H3 | 113.6° | 111.0° |
| C5 | C2 | C8 | 112.4° | 110.7° |
| C2 | C5 | N12 | 117.9° | 120.0° |
| C2 | C5 | O23 | 121.7° | 120.0° |
| C5 | C2 | H2 | 104.0° | 110.6° |
| C2 | C8 | N4 | 103.1° | 107.2° |
| C8 | C2 | H2 | 112.9° | 110.8° |
| C2 | C8 | H81C | 111.7° | 109.9° |
| C2 | C8 | H82C | 113.0° | 109.9° |
| C7 | C3 | C9 | 111.4° | 111.1° |
| C3 | C7 | N14 | 119.8° | 120.0° |
| C3 | C7 | O24 | 120.4° | 120.0° |
| C7 | C3 | H3 | 107.6° | 110.9° |
| C3 | C9 | N4 | 106.0° | 104.8° |
| C9 | C3 | H3 | 110.7° | 111.0° |
| C3 | C9 | H91C | 110.7° | 110.4° |
| C3 | C9 | H92C | 111.4° | 110.3° |
| C8 | N4 | C9 | 110.7° | 108.8° |
| N4 | C8 | H81C | 111.6° | 109.9° |
| N4 | C8 | H82C | 113.0° | 109.9° |
| N4 | C9 | H91C | 110.6° | 110.4° |
| N4 | C9 | H92C | 111.4° | 110.4° |
| N12 | C5 | O23 | 120.4° | 120.0° |
| C5 | N12 | C15 | 127.5° | 120.0° |
| C5 | N12 | H12 | 116.2° | 120.1° |
| C10 | N6 | C11 | 118.9° | 119.6° |
| C10 | N6 | C21 | 120.6° | 120.7° |
| N6 | C10 | C25 | 120.0° | 120.0° |
| N6 | C10 | O27 | 119.7° | 120.0° |
| C11 | N6 | C21 | 120.4° | 119.7° |
| N6 | C11 | C13 | 118.1° | 120.0° |
| N6 | C11 | C28 | 122.3° | 120.0° |
| N6 | C21 | C30 | 120.6° | 120.7° |
| N6 | C21 | H21 | 119.7° | 119.7° |
| N14 | C7 | O24 | 119.8° | 120.0° |
| C7 | N14 | C22 | 122.0° | 120.0° |
| C7 | N14 | H14 | 119.0° | 120.0° |
| C25 | C10 | O27 | 120.2° | 120.0° |
| C10 | C25 | C31 | 119.2° | 119.4° |
| C10 | C25 | H25 | 120.4° | 120.3° |
| C13 | C11 | C28 | 119.5° | 120.0° |
| C11 | C13 | C16 | 119.2° | 119.9° |
| C11 | C13 | H13 | 120.4° | 120.0° |
| C11 | C28 | C29 | 121.0° | 120.0° |
| C11 | C28 | H28 | 119.5° | 120.0° |
| N12 | C15 | C16 | 115.1° | 120.0° |
| N12 | C15 | C29 | 125.4° | 120.0° |
| C15 | N12 | H12 | 116.2° | 120.0° |
| C13 | C16 | C15 | 122.2° | 120.0° |
| C13 | C16 | F34 | 120.3° | 120.0° |
| C16 | C13 | H13 | 120.4° | 120.0° |
| N14 | C22 | C18 | 122.0° | 120.0° |
| N14 | C22 | C36 | 116.4° | 120.0° |
| C22 | N14 | H14 | 119.0° | 120.0° |
| C16 | C15 | C29 | 119.4° | 120.0° |
| C15 | C16 | F34 | 117.5° | 120.0° |
| C15 | C29 | C28 | 118.7° | 120.0° |
| C15 | C29 | H29 | 120.7° | 120.0° |
| C18 | C17 | C26 | 119.7° | 120.0° |
| C18 | C17 | F35 | 121.1° | 120.0° |
| C17 | C18 | C22 | 118.3° | 119.9° |
| C17 | C18 | H18 | 120.8° | 120.1° |
| C26 | C17 | F35 | 119.1° | 120.0° |
| C17 | C26 | C32 | 121.3° | 120.0° |
| C17 | C26 | O37 | 120.4° | 120.0° |
| C18 | C22 | C36 | 121.4° | 120.0° |
| C22 | C18 | H18 | 120.8° | 120.0° |
| C21 | C30 | C31 | 120.0° | 119.9° |
| C30 | C21 | H21 | 119.7° | 119.6° |
| C21 | C30 | H30 | 120.0° | 120.1° |
| C22 | C36 | C32 | 119.9° | 120.0° |
| C22 | C36 | H36 | 120.0° | 119.9° |
| C25 | C31 | C30 | 119.4° | 119.3° |
| C31 | C25 | H25 | 120.4° | 120.3° |
| C25 | C31 | H31 | 120.3° | 120.4° |
| C32 | C26 | O37 | 118.3° | 120.0° |
| C26 | C32 | C36 | 119.3° | 120.0° |
| C26 | C32 | H32 | 120.3° | 120.0° |
| C26 | O37 | C38 | 116.9° | 117.0° |
| C29 | C28 | H28 | 119.5° | 120.0° |
| C28 | C29 | H29 | 120.7° | 120.0° |
| C31 | C30 | H30 | 120.0° | 120.0° |
| C30 | C31 | H31 | 120.3° | 120.4° |
| C32 | C36 | H36 | 120.1° | 120.0° |
| C36 | C32 | H32 | 120.4° | 120.0° |
| O37 | C38 | H381 | 109.5° | 109.4° |
| O37 | C38 | H382 | 109.5° | 109.5° |
| O37 | C38 | H383 | 109.5° | 109.5° |
| H331 | C33 | H332 | 109.5° | 109.5° |
| H331 | C33 | H333 | 109.5° | 109.5° |
| H332 | C33 | H333 | 109.5° | 109.4° |
| H81C | C8 | H82C | 104.7° | 110.0° |
| H91C | C9 | H92C | 106.8° | 110.4° |
| H381 | C38 | H382 | 109.4° | 109.5° |
| H381 | C38 | H383 | 109.5° | 109.5° |
| H382 | C38 | H383 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N4 | S1 | O19 | O20 | 113.1° | 116.7° |
| N4 | S1 | O19 | C33 | 110.1° | 111.8° |
| N4 | S1 | O20 | C33 | 110.0° | 111.7° |
| S1 | N4 | C8 | C2 | 167.2° | 178.9° |
| S1 | N4 | C9 | C3 | 149.6° | 155.9° |
| S1 | N4 | C8 | C9 | 137.8° | 180.0° |
| N4 | S1 | C33 | H331 | 72.1° | 60.0° |
| N4 | S1 | C33 | H332 | 167.9° | 180.0° |
| N4 | S1 | C33 | H333 | 47.9° | 60.0° |
| S1 | N4 | C8 | H81C | 72.8° | 61.6° |
| S1 | N4 | C8 | H82C | 44.9° | 59.6° |
| S1 | N4 | C9 | H91C | 29.6° | 37.0° |
| S1 | N4 | C9 | H92C | 89.1° | 85.3° |
| O19 | S1 | O20 | C33 | 137.4° | 131.5° |
| O19 | S1 | N4 | C8 | 52.0° | 153.9° |
| O19 | S1 | N4 | C9 | 172.6° | 26.1° |
| O19 | S1 | C33 | H331 | 178.8° | 51.7° |
| O19 | S1 | C33 | H332 | 58.8° | 68.3° |
| O19 | S1 | C33 | H333 | 61.2° | 171.7° |
| O20 | S1 | N4 | C8 | 178.5° | 26.1° |
| O20 | S1 | N4 | C9 | 46.0° | 153.9° |
| O20 | S1 | C33 | H331 | 37.6° | 171.6° |
| O20 | S1 | C33 | H332 | 82.4° | 68.4° |
| O20 | S1 | C33 | H333 | 157.6° | 51.6° |
| C33 | S1 | N4 | C8 | 65.5° | 90.0° |
| C33 | S1 | N4 | C9 | 70.0° | 90.0° |
| S1 | C33 | H331 | H332 | 120.0° | 120.0° |
| S1 | C33 | H331 | H333 | 120.0° | 120.0° |
| S1 | C33 | H332 | H333 | 120.0° | 120.0° |
| C3 | C2 | C5 | C8 | 114.6° | 113.5° |
| C3 | C2 | C5 | H2 | 122.9° | 123.2° |
| C3 | C2 | C8 | H2 | 122.6° | 118.5° |
| C2 | C3 | C7 | C9 | 115.3° | 112.2° |
| C2 | C3 | C7 | H3 | 123.2° | 123.8° |
| C2 | C3 | C9 | H3 | 123.1° | 118.0° |
| C3 | C2 | C8 | N4 | 35.0° | 22.2° |
| C2 | C3 | C9 | N4 | 12.0° | 36.9° |
| C3 | C2 | C5 | N12 | 91.3° | 180.0° |
| C3 | C2 | C5 | O23 | 87.4° | 0.0° |
| C2 | C3 | C7 | N14 | 153.3° | 180.0° |
| C2 | C3 | C7 | O24 | 26.9° | 0.1° |
| C3 | C2 | C8 | H81C | 155.0° | 141.6° |
| C3 | C2 | C8 | H82C | 87.4° | 97.2° |
| C2 | C3 | C9 | H91C | 132.0° | 155.8° |
| C2 | C3 | C9 | H92C | 109.3° | 81.8° |
| C5 | C2 | C8 | H2 | 117.3° | 123.2° |
| C5 | C2 | C3 | C7 | 91.2° | 88.0° |
| C5 | C2 | C3 | C9 | 149.5° | 153.8° |
| C5 | C2 | C8 | N4 | 155.0° | 140.6° |
| C2 | C5 | N12 | O23 | 178.7° | 180.0° |
| C2 | C5 | N12 | C15 | 179.7° | 174.6° |
| C5 | C2 | C3 | H3 | 28.3° | 35.8° |
| C5 | C2 | C8 | H81C | 85.0° | 100.1° |
| C5 | C2 | C8 | H82C | 32.7° | 21.2° |
| C2 | C5 | N12 | H12 | 0.3° | 5.3° |
| C8 | C2 | C3 | C7 | 148.3° | 153.6° |
| C8 | C2 | C3 | C9 | 29.0° | 35.5° |
| C2 | C8 | N4 | H81C | 120.0° | 119.4° |
| C2 | C8 | N4 | H82C | 122.3° | 119.4° |
| C2 | C8 | N4 | C9 | 29.4° | 1.0° |
| C8 | C2 | C5 | N12 | 154.1° | 66.5° |
| C8 | C2 | C5 | O23 | 27.2° | 113.6° |
| C8 | C2 | C3 | H3 | 92.2° | 82.6° |
| C2 | C8 | H81C | H82C | 122.6° | 121.1° |
| C7 | C3 | C9 | H3 | 119.7° | 123.9° |
| C7 | C3 | C9 | N4 | 129.3° | 155.1° |
| C3 | C7 | N14 | O24 | 179.8° | 179.9° |
| C3 | C7 | N14 | C22 | 176.0° | 175.0° |
| C7 | C3 | C2 | H2 | 26.1° | 35.1° |
| C7 | C3 | C9 | H91C | 110.8° | 86.1° |
| C7 | C3 | C9 | H92C | 7.9° | 36.3° |
| C3 | C7 | N14 | H14 | 4.1° | 5.1° |
| C3 | C9 | N4 | C8 | 11.0° | 24.1° |
| C3 | C9 | N4 | H91C | 120.0° | 118.9° |
| C3 | C9 | N4 | H92C | 121.4° | 118.8° |
| C9 | C3 | C7 | N14 | 91.5° | 67.7° |
| C9 | C3 | C7 | O24 | 88.4° | 112.1° |
| C9 | C3 | C2 | H2 | 93.2° | 83.1° |
| C3 | C9 | H91C | H92C | 121.4° | 122.3° |
| N4 | C8 | C2 | H2 | 87.7° | 96.3° |
| N4 | C8 | H81C | H82C | 122.6° | 121.1° |
| C8 | N4 | C9 | H91C | 109.1° | 143.0° |
| C8 | N4 | C9 | H92C | 132.3° | 94.7° |
| N4 | C9 | C3 | H3 | 111.1° | 81.1° |
| C9 | N4 | C8 | H81C | 149.4° | 118.4° |
| C9 | N4 | C8 | H82C | 92.9° | 120.4° |
| N4 | C9 | H91C | H92C | 121.4° | 122.3° |
| C5 | N12 | C15 | H12 | 180.0° | 180.0° |
| C5 | N12 | C15 | C16 | 137.9° | 158.0° |
| C5 | N12 | C15 | C29 | 44.3° | 21.7° |
| N12 | C5 | C2 | H2 | 31.6° | 56.8° |
| O23 | C5 | N12 | C15 | 1.6° | 5.3° |
| O23 | C5 | C2 | H2 | 149.6° | 123.2° |
| O23 | C5 | N12 | H12 | 178.4° | 174.7° |
| C10 | N6 | C11 | C21 | 178.9° | 179.8° |
| N6 | C10 | C25 | O27 | 177.8° | 180.0° |
| C10 | N6 | C11 | C13 | 72.8° | 93.3° |
| C10 | N6 | C11 | C28 | 105.1° | 86.9° |
| C10 | N6 | C21 | C30 | 3.0° | 0.1° |
| N6 | C10 | C25 | C31 | 0.7° | 0.0° |
| C10 | N6 | C21 | H21 | 177.0° | 180.0° |
| N6 | C10 | C25 | H25 | 179.3° | 180.0° |
| C11 | N6 | C10 | C25 | 179.4° | 179.9° |
| C11 | N6 | C10 | O27 | 1.5° | 0.0° |
| N6 | C11 | C13 | C28 | 178.0° | 179.8° |
| N6 | C11 | C13 | C16 | 178.7° | 180.0° |
| C11 | N6 | C21 | C30 | 178.1° | 179.7° |
| N6 | C11 | C28 | C29 | 180.0° | 180.0° |
| C11 | N6 | C21 | H21 | 1.9° | 0.2° |
| N6 | C11 | C13 | H13 | 1.3° | 0.0° |
| N6 | C11 | C28 | H28 | 0.1° | 0.0° |
| C21 | N6 | C10 | C25 | 1.7° | 0.3° |
| C21 | N6 | C10 | O27 | 179.6° | 179.8° |
| C21 | N6 | C11 | C13 | 106.1° | 86.5° |
| C21 | N6 | C11 | C28 | 76.0° | 93.3° |
| N6 | C21 | C30 | H21 | 180.0° | 179.9° |
| N6 | C21 | C30 | C31 | 1.8° | 0.6° |
| N6 | C21 | C30 | H30 | 178.2° | 180.0° |
| C7 | N14 | C22 | H14 | 180.0° | 179.9° |
| C7 | N14 | C22 | C18 | 1.5° | 144.0° |
| C7 | N14 | C22 | C36 | 173.0° | 35.9° |
| N14 | C7 | C3 | H3 | 30.0° | 56.2° |
| O24 | C7 | N14 | C22 | 4.2° | 4.9° |
| O24 | C7 | C3 | H3 | 150.1° | 123.9° |
| O24 | C7 | N14 | H14 | 175.8° | 175.0° |
| C10 | C25 | C31 | H25 | 180.0° | 180.0° |
| C10 | C25 | C31 | C30 | 1.9° | 0.5° |
| C10 | C25 | C31 | H31 | 178.1° | 179.9° |
| O27 | C10 | C25 | C31 | 177.1° | 180.0° |
| O27 | C10 | C25 | H25 | 2.9° | 0.0° |
| C11 | C13 | C16 | H13 | 180.0° | 180.0° |
| C11 | C13 | C16 | C15 | 0.0° | 0.0° |
| C11 | C13 | C16 | F34 | 179.3° | 180.0° |
| C13 | C11 | C28 | C29 | 2.1° | 0.2° |
| C13 | C11 | C28 | H28 | 178.0° | 179.8° |
| C28 | C11 | C13 | C16 | 0.7° | 0.2° |
| C11 | C28 | C29 | C15 | 2.7° | 0.1° |
| C11 | C28 | C29 | H28 | 180.0° | 179.9° |
| C28 | C11 | C13 | H13 | 179.3° | 179.8° |
| C11 | C28 | C29 | H29 | 177.3° | 179.8° |
| N12 | C15 | C16 | C13 | 178.6° | 180.0° |
| N12 | C15 | C16 | C29 | 178.0° | 179.7° |
| N12 | C15 | C16 | F34 | 0.7° | 0.0° |
| N12 | C15 | C29 | C28 | 179.7° | 180.0° |
| N12 | C15 | C29 | H29 | 0.3° | 0.3° |
| C13 | C16 | C15 | F34 | 179.3° | 180.0° |
| C13 | C16 | C15 | C29 | 0.6° | 0.3° |
| N14 | C22 | C18 | C17 | 177.2° | 180.0° |
| N14 | C22 | C18 | C36 | 174.2° | 180.0° |
| N14 | C22 | C36 | C32 | 177.2° | 180.0° |
| N14 | C22 | C18 | H18 | 2.8° | 0.0° |
| N14 | C22 | C36 | H36 | 2.9° | 0.0° |
| C16 | C15 | C29 | C28 | 1.9° | 0.3° |
| C16 | C15 | N12 | H12 | 42.1° | 22.1° |
| C15 | C16 | C13 | H13 | 180.0° | 180.0° |
| C16 | C15 | C29 | H29 | 178.1° | 180.0° |
| C29 | C15 | C16 | F34 | 178.7° | 179.7° |
| C15 | C29 | C28 | H29 | 180.0° | 179.7° |
| C29 | C15 | N12 | H12 | 135.8° | 158.2° |
| C15 | C29 | C28 | H28 | 177.4° | 180.0° |
| F34 | C16 | C13 | H13 | 0.7° | 0.0° |
| C18 | C17 | C26 | F35 | 178.8° | 179.7° |
| C17 | C18 | C22 | H18 | 180.0° | 180.0° |
| C17 | C18 | C22 | C36 | 3.0° | 0.0° |
| C18 | C17 | C26 | C32 | 1.0° | 0.1° |
| C18 | C17 | C26 | O37 | 179.2° | 180.0° |
| C26 | C17 | C18 | C22 | 2.1° | 0.1° |
| C17 | C26 | C32 | O37 | 179.8° | 179.9° |
| C17 | C26 | C32 | C36 | 0.6° | 0.0° |
| C17 | C26 | O37 | C38 | 156.4° | 180.0° |
| C26 | C17 | C18 | H18 | 177.9° | 180.0° |
| C17 | C26 | C32 | H32 | 179.4° | 180.0° |
| F35 | C17 | C18 | C22 | 179.0° | 179.8° |
| F35 | C17 | C26 | C32 | 179.9° | 179.7° |
| F35 | C17 | C26 | O37 | 0.4° | 0.3° |
| F35 | C17 | C18 | H18 | 1.0° | 0.3° |
| C18 | C22 | C36 | C32 | 2.7° | 0.0° |
| C18 | C22 | N14 | H14 | 178.5° | 36.0° |
| C18 | C22 | C36 | H36 | 177.4° | 180.0° |
| C21 | C30 | C31 | C25 | 0.6° | 0.9° |
| C21 | C30 | C31 | H30 | 180.0° | 179.4° |
| C21 | C30 | C31 | H31 | 179.4° | 179.7° |
| C22 | C36 | C32 | C26 | 1.4° | 0.0° |
| C22 | C36 | C32 | H36 | 180.0° | 180.0° |
| C36 | C22 | N14 | H14 | 7.0° | 144.0° |
| C36 | C22 | C18 | H18 | 177.0° | 180.0° |
| C22 | C36 | C32 | H32 | 178.6° | 180.0° |
| C25 | C31 | C30 | H31 | 180.0° | 179.4° |
| C25 | C31 | C30 | H30 | 179.3° | 179.7° |
| C26 | C32 | C36 | H32 | 180.0° | 180.0° |
| C32 | C26 | O37 | C38 | 23.8° | 0.1° |
| C26 | C32 | C36 | H36 | 178.6° | 180.0° |
| O37 | C26 | C32 | C36 | 179.6° | 179.9° |
| O37 | C26 | C32 | H32 | 0.4° | 0.0° |
| C26 | O37 | C38 | H381 | 115.1° | 60.0° |
| C26 | O37 | C38 | H382 | 124.9° | 60.0° |
| C26 | O37 | C38 | H383 | 4.9° | 179.9° |
| C31 | C30 | C21 | H21 | 178.2° | 179.4° |
| C30 | C31 | C25 | H25 | 178.1° | 179.4° |
| O37 | C38 | H381 | H382 | 120.0° | 120.0° |
| O37 | C38 | H381 | H383 | 120.0° | 120.0° |
| O37 | C38 | H382 | H383 | 120.0° | 120.0° |
| H331 | C33 | H332 | H333 | 120.0° | 120.0° |
| H2 | C2 | C3 | H3 | 145.6° | 158.9° |
| H2 | C2 | C8 | H81C | 32.3° | 23.1° |
| H2 | C2 | C8 | H82C | 150.0° | 144.3° |
| H3 | C3 | C9 | H91C | 8.9° | 37.8° |
| H3 | C3 | C9 | H92C | 127.6° | 160.1° |
| H21 | C21 | C30 | H30 | 1.8° | 0.1° |
| H25 | C25 | C31 | H31 | 1.9° | 0.0° |
| H28 | C28 | C29 | H29 | 2.6° | 0.3° |
| H30 | C30 | C31 | H31 | 0.6° | 0.3° |
| H36 | C36 | C32 | H32 | 1.4° | 0.0° |
| H381 | C38 | H382 | H383 | 120.0° | 120.0° |
