SIQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C30 | C26 | sing | 1.57Å | 1.57Å | |
| C30 | C29 | sing | 1.57Å | 1.57Å | |
| C25 | C26 | sing | 1.56Å | 1.56Å | |
| C25 | N24 | sing | 1.48Å | 1.48Å | |
| C26 | N27 | sing | 1.49Å | 1.49Å | |
| N24 | C29 | sing | 1.53Å | 1.50Å | |
| N24 | C5 | sing | 1.39Å | 1.40Å | |
| C12 | C8 | sing | 1.56Å | 1.56Å | |
| C12 | C10 | sing | 1.56Å | 1.59Å | |
| N6 | C5 | doub | 1.33Å | 1.33Å | Aromatic |
| N6 | C1 | sing | 1.32Å | 1.33Å | Aromatic |
| C8 | N7 | sing | 1.50Å | 1.50Å | |
| C8 | C9 | sing | 1.55Å | 1.55Å | |
| C29 | C28 | sing | 1.56Å | 1.56Å | |
| C5 | C4 | sing | 1.39Å | 1.40Å | Aromatic |
| N7 | C1 | sing | 1.39Å | 1.40Å | |
| N7 | C11 | sing | 1.50Å | 1.50Å | |
| C1 | C2 | doub | 1.39Å | 1.39Å | Aromatic |
| C4 | C3 | doub | 1.40Å | 1.40Å | Aromatic |
| N27 | C28 | sing | 1.48Å | 1.50Å | |
| N27 | C31 | sing | 1.35Å | 1.35Å | |
| C2 | C3 | sing | 1.40Å | 1.40Å | Aromatic |
| O32 | C31 | doub | 1.22Å | 1.21Å | |
| C10 | C9 | sing | 1.55Å | 1.55Å | |
| C10 | C11 | sing | 1.57Å | 1.56Å | |
| C3 | C13 | sing | 1.48Å | 1.48Å | |
| C31 | O33 | sing | 1.35Å | 1.35Å | |
| C13 | C18 | doub | 1.39Å | 1.40Å | Aromatic |
| C13 | N14 | sing | 1.33Å | 1.33Å | Aromatic |
| C18 | N17 | sing | 1.32Å | 1.33Å | Aromatic |
| N14 | C15 | doub | 1.32Å | 1.32Å | Aromatic |
| N17 | C16 | doub | 1.32Å | 1.33Å | Aromatic |
| C15 | C16 | sing | 1.40Å | 1.40Å | Aromatic |
| C15 | O20 | sing | 1.36Å | 1.36Å | |
| O33 | C34 | sing | 1.45Å | 1.45Å | |
| C16 | N19 | sing | 1.39Å | 1.39Å | |
| O20 | C21 | sing | 1.43Å | 1.43Å | |
| F22 | C21 | sing | 1.40Å | 1.40Å | |
| C21 | F23 | sing | 1.40Å | 1.40Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C8 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C21 | H4 | sing | 1.09Å | 1.10Å | |
| C26 | H5 | sing | 1.09Å | 1.10Å | |
| C28 | H6 | sing | 1.09Å | 1.10Å | |
| C28 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C18 | H15 | sing | 1.08Å | 1.08Å | |
| N19 | H16 | sing | 0.97Å | 1.00Å | |
| N19 | H17 | sing | 0.97Å | 1.00Å | |
| C25 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H19 | sing | 1.09Å | 1.10Å | |
| C29 | H20 | sing | 1.09Å | 1.10Å | |
| C30 | H21 | sing | 1.09Å | 1.10Å | |
| C30 | H22 | sing | 1.09Å | 1.10Å | |
| C34 | H23 | sing | 1.09Å | 1.10Å | |
| C34 | H24 | sing | 1.09Å | 1.10Å | |
| C34 | H25 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C26 | C30 | C29 | 95.0° | 94.3° |
| C30 | C26 | C25 | 101.7° | 100.5° |
| C30 | C26 | N27 | 100.7° | 101.0° |
| C30 | C26 | H5 | 116.0° | 116.5° |
| C26 | C30 | H21 | 113.0° | 112.3° |
| C26 | C30 | H22 | 113.0° | 112.3° |
| C30 | C29 | N24 | 97.7° | 100.9° |
| C30 | C29 | C28 | 98.9° | 99.6° |
| C30 | C29 | H20 | 116.3° | 117.4° |
| C29 | C30 | H21 | 113.0° | 112.4° |
| C29 | C30 | H22 | 113.0° | 112.4° |
| C26 | C25 | N24 | 102.6° | 105.1° |
| C25 | C26 | N27 | 102.5° | 104.1° |
| C25 | C26 | H5 | 116.1° | 116.2° |
| C26 | C25 | H18 | 111.2° | 110.4° |
| C26 | C25 | H19 | 111.2° | 110.3° |
| C25 | N24 | C29 | 108.6° | 105.7° |
| C25 | N24 | C5 | 120.3° | 111.5° |
| N24 | C25 | H18 | 111.1° | 110.3° |
| N24 | C25 | H19 | 111.1° | 110.3° |
| C26 | N27 | C28 | 105.8° | 106.1° |
| C26 | N27 | C31 | 127.0° | 126.9° |
| N27 | C26 | H5 | 117.4° | 116.1° |
| C29 | N24 | C5 | 121.2° | 111.0° |
| N24 | C29 | C28 | 106.7° | 103.4° |
| N24 | C29 | H20 | 117.7° | 116.2° |
| N24 | C5 | N6 | 119.5° | 119.6° |
| N24 | C5 | C4 | 119.8° | 119.6° |
| C8 | C12 | C10 | 81.2° | 81.5° |
| C12 | C8 | N7 | 102.8° | 108.3° |
| C12 | C8 | C9 | 81.7° | 81.7° |
| C12 | C8 | H2 | 118.9° | 119.7° |
| C8 | C12 | H13 | 116.0° | 114.5° |
| C8 | C12 | H14 | 116.0° | 114.6° |
| C12 | C10 | C9 | 80.8° | 81.5° |
| C12 | C10 | C11 | 109.0° | 106.4° |
| C12 | C10 | H3 | 119.7° | 120.8° |
| C10 | C12 | H13 | 116.0° | 114.5° |
| C10 | C12 | H14 | 116.0° | 114.5° |
| C5 | N6 | C1 | 121.8° | 121.8° |
| N6 | C5 | C4 | 120.6° | 120.8° |
| N6 | C1 | N7 | 122.7° | 119.6° |
| N6 | C1 | C2 | 120.0° | 120.8° |
| N7 | C8 | C9 | 107.2° | 103.5° |
| C8 | N7 | C1 | 119.8° | 111.0° |
| C8 | N7 | C11 | 101.0° | 101.0° |
| N7 | C8 | H2 | 120.1° | 117.5° |
| C8 | C9 | C10 | 82.7° | 82.1° |
| C9 | C8 | H2 | 119.0° | 120.0° |
| C8 | C9 | H9 | 115.7° | 114.4° |
| C8 | C9 | H10 | 115.7° | 114.4° |
| C29 | C28 | N27 | 105.1° | 105.1° |
| C29 | C28 | H6 | 110.5° | 110.3° |
| C29 | C28 | H7 | 110.5° | 110.4° |
| C28 | C29 | H20 | 116.5° | 116.7° |
| C5 | C4 | C3 | 119.4° | 119.1° |
| C5 | C4 | H1 | 120.3° | 120.4° |
| C1 | N7 | C11 | 116.2° | 111.0° |
| N7 | C1 | C2 | 117.3° | 119.6° |
| N7 | C11 | C10 | 98.0° | 99.2° |
| N7 | C11 | H11 | 112.3° | 111.5° |
| N7 | C11 | H12 | 112.3° | 111.5° |
| C1 | C2 | C3 | 120.4° | 119.1° |
| C1 | C2 | H8 | 119.8° | 120.4° |
| C4 | C3 | C2 | 117.8° | 118.3° |
| C4 | C3 | C13 | 123.9° | 120.8° |
| C3 | C4 | H1 | 120.3° | 120.5° |
| C28 | N27 | C31 | 127.2° | 126.9° |
| N27 | C28 | H6 | 110.6° | 110.3° |
| N27 | C28 | H7 | 110.5° | 110.3° |
| N27 | C31 | O32 | 119.7° | 120.0° |
| N27 | C31 | O33 | 121.4° | 120.0° |
| C2 | C3 | C13 | 118.3° | 120.9° |
| C3 | C2 | H8 | 119.8° | 120.4° |
| O32 | C31 | O33 | 118.8° | 120.1° |
| C9 | C10 | C11 | 98.5° | 101.8° |
| C9 | C10 | H3 | 120.6° | 121.0° |
| C10 | C9 | H9 | 115.7° | 114.5° |
| C10 | C9 | H10 | 115.7° | 114.4° |
| C11 | C10 | H3 | 120.2° | 118.4° |
| C10 | C11 | H11 | 112.3° | 111.4° |
| C10 | C11 | H12 | 112.2° | 111.4° |
| C3 | C13 | C18 | 124.2° | 120.0° |
| C3 | C13 | N14 | 116.8° | 119.9° |
| C31 | O33 | C34 | 121.3° | 117.0° |
| C18 | C13 | N14 | 119.0° | 120.1° |
| C13 | C18 | N17 | 119.7° | 120.1° |
| C13 | C18 | H15 | 120.2° | 120.0° |
| C13 | N14 | C15 | 121.9° | 119.9° |
| C18 | N17 | C16 | 120.8° | 120.1° |
| N17 | C18 | H15 | 120.2° | 119.9° |
| N14 | C15 | C16 | 119.1° | 119.9° |
| N14 | C15 | O20 | 119.4° | 120.0° |
| N17 | C16 | C15 | 119.6° | 120.0° |
| N17 | C16 | N19 | 120.5° | 120.0° |
| C16 | C15 | O20 | 121.5° | 120.1° |
| C15 | C16 | N19 | 120.0° | 120.0° |
| C15 | O20 | C21 | 117.4° | 117.0° |
| O33 | C34 | H23 | 109.5° | 109.4° |
| O33 | C34 | H24 | 109.5° | 109.5° |
| O33 | C34 | H25 | 109.5° | 109.5° |
| C16 | N19 | H16 | 109.5° | 120.0° |
| C16 | N19 | H17 | 109.5° | 120.0° |
| O20 | C21 | F22 | 109.6° | 109.5° |
| O20 | C21 | F23 | 108.2° | 109.5° |
| O20 | C21 | H4 | 109.4° | 109.4° |
| F22 | C21 | F23 | 109.7° | 109.5° |
| F22 | C21 | H4 | 109.9° | 109.5° |
| F23 | C21 | H4 | 110.0° | 109.5° |
| H6 | C28 | H7 | 109.5° | 110.3° |
| H9 | C9 | H10 | 109.5° | 113.5° |
| H11 | C11 | H12 | 109.5° | 111.3° |
| H13 | C12 | H14 | 109.5° | 113.6° |
| H16 | N19 | H17 | 109.5° | 120.0° |
| H18 | C25 | H19 | 109.5° | 110.4° |
| H21 | C30 | H22 | 109.5° | 112.1° |
| H23 | C34 | H24 | 109.5° | 109.5° |
| H23 | C34 | H25 | 109.5° | 109.5° |
| H24 | C34 | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C26 | C30 | C29 | H21 | 117.6° | 116.3° |
| C26 | C30 | C29 | H22 | 117.5° | 116.3° |
| C30 | C26 | C25 | N27 | 103.9° | 104.3° |
| C30 | C26 | C25 | H5 | 126.8° | 126.7° |
| C30 | C26 | C25 | N24 | 26.1° | 33.1° |
| C30 | C26 | N27 | H5 | 126.9° | 127.0° |
| C26 | C30 | C29 | N24 | 55.5° | 53.8° |
| C26 | C30 | C29 | C28 | 52.9° | 52.0° |
| C30 | C26 | N27 | C28 | 35.4° | 36.2° |
| C30 | C26 | N27 | C31 | 144.1° | 143.9° |
| C30 | C26 | C25 | H18 | 144.9° | 152.0° |
| C30 | C26 | C25 | H19 | 92.8° | 85.8° |
| C26 | C30 | C29 | H20 | 178.5° | 178.9° |
| C26 | C30 | H21 | H22 | 126.8° | 127.6° |
| C29 | C30 | C26 | C25 | 50.3° | 52.3° |
| C30 | C29 | N24 | C25 | 42.7° | 35.6° |
| C29 | C30 | C26 | N27 | 54.9° | 54.5° |
| C30 | C29 | N24 | C28 | 101.8° | 102.7° |
| C30 | C29 | N24 | H20 | 125.1° | 128.1° |
| C30 | C29 | N24 | C5 | 171.7° | 156.6° |
| C30 | C29 | C28 | H20 | 125.4° | 127.4° |
| C30 | C29 | C28 | N27 | 33.7° | 32.8° |
| C29 | C30 | C26 | H5 | 177.3° | 178.8° |
| C30 | C29 | C28 | H6 | 153.0° | 86.1° |
| C30 | C29 | C28 | H7 | 85.6° | 151.8° |
| C29 | C30 | H21 | H22 | 126.8° | 127.6° |
| C26 | C25 | N24 | H18 | 118.9° | 119.0° |
| C26 | C25 | N24 | H19 | 118.9° | 118.9° |
| C25 | C26 | N27 | H5 | 128.5° | 129.1° |
| C26 | C25 | N24 | C29 | 10.5° | 1.5° |
| C26 | C25 | N24 | C5 | 156.5° | 122.2° |
| C25 | C26 | N27 | C28 | 69.3° | 67.7° |
| C25 | C26 | N27 | C31 | 111.2° | 112.2° |
| C26 | C25 | H18 | H19 | 123.2° | 122.2° |
| C25 | C26 | C30 | H21 | 67.2° | 64.0° |
| C25 | C26 | C30 | H22 | 167.9° | 168.6° |
| N24 | C25 | C26 | N27 | 77.8° | 71.2° |
| C25 | N24 | C29 | C5 | 145.6° | 121.0° |
| C25 | N24 | C5 | N6 | 22.0° | 144.7° |
| C25 | N24 | C29 | C28 | 59.1° | 67.1° |
| C25 | N24 | C5 | C4 | 161.3° | 35.3° |
| N24 | C25 | C26 | H5 | 152.9° | 159.8° |
| N24 | C25 | H18 | H19 | 123.1° | 122.1° |
| C25 | N24 | C29 | H20 | 167.8° | 163.7° |
| C26 | N27 | C28 | C29 | 0.9° | 2.0° |
| C26 | N27 | C28 | C31 | 179.5° | 180.0° |
| C26 | N27 | C31 | O32 | 0.6° | 0.1° |
| C26 | N27 | C31 | O33 | 179.0° | 180.0° |
| C26 | N27 | C28 | H6 | 118.4° | 120.8° |
| C26 | N27 | C28 | H7 | 120.2° | 117.1° |
| N27 | C26 | C25 | H18 | 41.1° | 47.7° |
| N27 | C26 | C25 | H19 | 163.3° | 169.9° |
| N27 | C26 | C30 | H21 | 172.4° | 170.7° |
| N27 | C26 | C30 | H22 | 62.6° | 61.9° |
| C29 | N24 | C5 | N6 | 163.7° | 27.2° |
| N24 | C29 | C28 | H20 | 133.8° | 128.8° |
| C29 | N24 | C5 | C4 | 19.6° | 152.9° |
| N24 | C29 | C28 | N27 | 67.2° | 71.0° |
| N24 | C29 | C28 | H6 | 52.2° | 170.1° |
| N24 | C29 | C28 | H7 | 173.5° | 48.0° |
| C29 | N24 | C25 | H18 | 108.4° | 117.5° |
| C29 | N24 | C25 | H19 | 129.4° | 120.4° |
| N24 | C29 | C30 | H21 | 62.1° | 62.5° |
| N24 | C29 | C30 | H22 | 173.0° | 170.1° |
| N24 | C5 | N6 | C4 | 176.7° | 180.0° |
| N24 | C5 | N6 | C1 | 178.8° | 180.0° |
| C5 | N24 | C29 | C28 | 86.5° | 53.9° |
| N24 | C5 | C4 | C3 | 178.4° | 179.9° |
| N24 | C5 | C4 | H1 | 1.5° | 0.3° |
| C5 | N24 | C25 | H18 | 37.6° | 3.2° |
| C5 | N24 | C25 | H19 | 84.6° | 119.0° |
| C5 | N24 | C29 | H20 | 46.6° | 75.3° |
| C8 | C12 | C10 | H13 | 114.7° | 113.2° |
| C8 | C12 | C10 | H14 | 114.7° | 113.2° |
| C12 | C8 | N7 | C9 | 85.1° | 85.6° |
| C12 | C8 | N7 | H2 | 134.8° | 139.6° |
| C12 | C8 | C9 | H2 | 118.5° | 119.6° |
| C12 | C8 | N7 | C1 | 173.8° | 159.3° |
| C12 | C8 | N7 | C11 | 57.2° | 41.6° |
| C8 | C12 | C10 | C9 | 41.7° | 41.5° |
| C8 | C12 | C10 | C11 | 54.2° | 58.4° |
| C8 | C12 | C10 | H3 | 161.8° | 162.7° |
| C12 | C8 | C9 | H9 | 157.6° | 155.1° |
| C12 | C8 | C9 | H10 | 72.5° | 71.5° |
| C8 | C12 | H13 | H14 | 133.6° | 134.2° |
| C10 | C12 | C8 | N7 | 64.5° | 60.0° |
| C12 | C10 | C11 | N7 | 26.6° | 41.2° |
| C12 | C10 | C9 | C11 | 108.0° | 105.1° |
| C12 | C10 | C9 | H3 | 119.2° | 121.0° |
| C12 | C10 | C11 | H3 | 143.9° | 140.1° |
| C10 | C12 | C8 | H2 | 160.1° | 161.5° |
| C12 | C10 | C9 | H9 | 156.7° | 155.0° |
| C12 | C10 | C9 | H10 | 73.4° | 71.6° |
| C12 | C10 | C11 | H11 | 91.5° | 158.7° |
| C12 | C10 | C11 | H12 | 144.7° | 76.4° |
| C10 | C12 | H13 | H14 | 133.6° | 134.1° |
| C5 | N6 | C1 | N7 | 179.9° | 179.7° |
| C5 | N6 | C1 | C2 | 2.2° | 0.3° |
| N6 | C5 | C4 | C3 | 1.7° | 0.0° |
| N6 | C5 | C4 | H1 | 178.2° | 179.7° |
| N6 | C1 | N7 | C8 | 22.6° | 0.5° |
| C1 | N6 | C5 | C4 | 2.1° | 0.0° |
| N6 | C1 | N7 | C2 | 177.8° | 179.4° |
| N6 | C1 | N7 | C11 | 144.5° | 110.9° |
| N6 | C1 | C2 | C3 | 1.8° | 0.6° |
| N6 | C1 | C2 | H8 | 178.2° | 180.0° |
| N7 | C8 | C9 | H2 | 140.6° | 133.5° |
| C8 | N7 | C1 | C11 | 121.9° | 111.5° |
| C8 | N7 | C1 | C2 | 159.5° | 179.9° |
| N7 | C8 | C9 | C10 | 58.3° | 65.1° |
| C8 | N7 | C11 | C10 | 16.3° | 0.1° |
| N7 | C8 | C9 | H9 | 56.7° | 48.2° |
| N7 | C8 | C9 | H10 | 173.3° | 178.4° |
| C8 | N7 | C11 | H11 | 134.4° | 117.6° |
| C8 | N7 | C11 | H12 | 101.7° | 117.4° |
| N7 | C8 | C12 | H13 | 179.2° | 173.1° |
| N7 | C8 | C12 | H14 | 50.2° | 53.1° |
| C9 | C8 | N7 | C1 | 101.1° | 73.7° |
| C9 | C8 | N7 | C11 | 27.9° | 44.0° |
| C8 | C9 | C10 | H9 | 115.0° | 113.3° |
| C8 | C9 | C10 | H10 | 115.1° | 113.3° |
| C8 | C9 | C10 | C11 | 66.3° | 63.4° |
| C8 | C9 | C10 | H3 | 160.9° | 162.7° |
| C8 | C9 | H9 | H10 | 132.9° | 133.9° |
| C9 | C8 | C12 | H13 | 73.3° | 71.5° |
| C9 | C8 | C12 | H14 | 156.1° | 154.7° |
| C29 | C28 | N27 | H6 | 119.3° | 118.9° |
| C29 | C28 | N27 | H7 | 119.3° | 119.0° |
| C29 | C28 | N27 | C31 | 178.6° | 178.1° |
| C29 | C28 | H6 | H7 | 122.0° | 122.2° |
| C28 | C29 | C30 | H21 | 170.5° | 168.2° |
| C28 | C29 | C30 | H22 | 64.6° | 64.3° |
| C5 | C4 | C3 | H1 | 180.0° | 179.8° |
| C5 | C4 | C3 | C2 | 1.4° | 0.3° |
| C5 | C4 | C3 | C13 | 179.3° | 179.7° |
| N7 | C1 | C2 | C3 | 179.7° | 180.0° |
| C1 | N7 | C11 | C10 | 147.7° | 117.6° |
| C1 | N7 | C8 | H2 | 39.0° | 61.1° |
| N7 | C1 | C2 | H8 | 0.3° | 0.6° |
| C1 | N7 | C11 | H11 | 94.3° | 0.2° |
| C1 | N7 | C11 | H12 | 29.6° | 124.9° |
| C11 | N7 | C1 | C2 | 37.7° | 68.4° |
| N7 | C11 | C10 | C9 | 56.6° | 43.3° |
| N7 | C11 | C10 | H11 | 118.1° | 117.5° |
| N7 | C11 | C10 | H12 | 118.1° | 117.6° |
| C11 | N7 | C8 | H2 | 168.1° | 178.9° |
| N7 | C11 | C10 | H3 | 170.5° | 178.7° |
| N7 | C11 | H11 | H12 | 125.4° | 125.2° |
| C1 | C2 | C3 | C4 | 1.4° | 0.6° |
| C1 | C2 | C3 | H8 | 180.0° | 179.4° |
| C1 | C2 | C3 | C13 | 179.5° | 179.4° |
| C4 | C3 | C2 | C13 | 178.0° | 180.0° |
| C4 | C3 | C13 | C18 | 1.2° | 5.0° |
| C4 | C3 | C13 | N14 | 178.7° | 174.7° |
| C4 | C3 | C2 | H8 | 178.6° | 179.9° |
| C28 | N27 | C31 | O32 | 180.0° | 180.0° |
| C28 | N27 | C31 | O33 | 1.6° | 0.1° |
| C28 | N27 | C26 | H5 | 162.3° | 163.2° |
| N27 | C28 | H6 | H7 | 122.0° | 122.1° |
| N27 | C28 | C29 | H20 | 159.1° | 160.2° |
| N27 | C31 | O32 | O33 | 178.4° | 179.9° |
| N27 | C31 | O33 | C34 | 62.0° | 180.0° |
| C31 | N27 | C26 | H5 | 17.2° | 16.8° |
| C31 | N27 | C28 | H6 | 62.1° | 59.2° |
| C31 | N27 | C28 | H7 | 59.3° | 62.9° |
| C2 | C3 | C13 | C18 | 176.7° | 175.0° |
| C2 | C3 | C13 | N14 | 0.8° | 5.3° |
| C2 | C3 | C4 | H1 | 178.6° | 180.0° |
| O32 | C31 | O33 | C34 | 119.6° | 0.1° |
| C9 | C10 | C11 | H3 | 133.0° | 135.4° |
| C10 | C9 | C8 | H2 | 161.1° | 161.4° |
| C10 | C9 | H9 | H10 | 132.9° | 133.9° |
| C9 | C10 | C11 | H11 | 174.7° | 74.2° |
| C9 | C10 | C11 | H12 | 61.5° | 160.9° |
| C9 | C10 | C12 | H13 | 73.0° | 71.7° |
| C9 | C10 | C12 | H14 | 156.4° | 154.7° |
| C11 | C10 | C9 | H9 | 48.7° | 49.9° |
| C11 | C10 | C9 | H10 | 178.6° | 176.7° |
| C10 | C11 | H11 | H12 | 125.3° | 125.0° |
| C11 | C10 | C12 | H13 | 168.9° | 171.6° |
| C11 | C10 | C12 | H14 | 60.5° | 54.8° |
| C3 | C13 | C18 | N14 | 177.5° | 179.7° |
| C3 | C13 | C18 | N17 | 178.6° | 179.7° |
| C3 | C13 | N14 | C15 | 179.2° | 179.7° |
| C13 | C3 | C4 | H1 | 0.6° | 0.0° |
| C13 | C3 | C2 | H8 | 0.5° | 0.0° |
| C3 | C13 | C18 | H15 | 1.3° | 0.3° |
| C31 | O33 | C34 | H23 | 180.0° | 60.1° |
| C31 | O33 | C34 | H24 | 60.0° | 59.9° |
| C31 | O33 | C34 | H25 | 60.0° | 180.0° |
| C13 | C18 | N17 | H15 | 180.0° | 180.0° |
| C18 | C13 | N14 | C15 | 1.6° | 0.0° |
| C13 | C18 | N17 | C16 | 0.7° | 0.0° |
| N14 | C13 | C18 | N17 | 1.2° | 0.0° |
| C13 | N14 | C15 | C16 | 1.4° | 0.0° |
| C13 | N14 | C15 | O20 | 179.7° | 179.9° |
| N14 | C13 | C18 | H15 | 178.8° | 180.0° |
| C18 | N17 | C16 | C15 | 0.5° | 0.1° |
| C18 | N17 | C16 | N19 | 179.7° | 179.9° |
| N14 | C15 | C16 | N17 | 0.8° | 0.1° |
| N14 | C15 | C16 | O20 | 178.9° | 179.9° |
| N14 | C15 | C16 | N19 | 179.9° | 179.9° |
| N14 | C15 | O20 | C21 | 21.9° | 0.1° |
| N17 | C16 | C15 | N19 | 179.2° | 180.0° |
| N17 | C16 | C15 | O20 | 179.7° | 180.0° |
| C16 | N17 | C18 | H15 | 179.3° | 180.0° |
| N17 | C16 | N19 | H16 | 0.0° | 180.0° |
| N17 | C16 | N19 | H17 | 120.0° | 0.0° |
| C16 | C15 | O20 | C21 | 159.2° | 180.0° |
| C15 | C16 | N19 | H16 | 179.3° | 0.1° |
| C15 | C16 | N19 | H17 | 59.2° | 180.0° |
| O20 | C15 | C16 | N19 | 1.1° | 0.1° |
| C15 | O20 | C21 | F22 | 163.4° | 60.0° |
| C15 | O20 | C21 | F23 | 77.0° | 60.0° |
| C15 | O20 | C21 | H4 | 42.7° | 180.0° |
| O33 | C34 | H23 | H24 | 120.0° | 120.0° |
| O33 | C34 | H23 | H25 | 120.0° | 120.0° |
| O33 | C34 | H24 | H25 | 120.0° | 120.0° |
| C16 | N19 | H16 | H17 | 120.0° | 180.0° |
| O20 | C21 | F22 | F23 | 118.6° | 120.0° |
| O20 | C21 | F22 | H4 | 120.3° | 120.0° |
| O20 | C21 | F23 | H4 | 119.4° | 120.0° |
| F22 | C21 | F23 | H4 | 121.0° | 120.0° |
| H2 | C8 | C9 | H9 | 83.9° | 85.3° |
| H2 | C8 | C9 | H10 | 46.1° | 48.1° |
| H2 | C8 | C12 | H13 | 45.3° | 48.4° |
| H2 | C8 | C12 | H14 | 85.2° | 85.4° |
| H3 | C10 | C9 | H9 | 84.1° | 84.0° |
| H3 | C10 | C9 | H10 | 45.9° | 49.4° |
| H3 | C10 | C11 | H11 | 52.3° | 61.2° |
| H3 | C10 | C11 | H12 | 71.5° | 63.7° |
| H3 | C10 | C12 | H13 | 47.0° | 49.5° |
| H3 | C10 | C12 | H14 | 83.5° | 84.1° |
| H5 | C26 | C25 | H18 | 88.2° | 81.3° |
| H5 | C26 | C25 | H19 | 34.0° | 40.9° |
| H5 | C26 | C30 | H21 | 59.7° | 62.5° |
| H5 | C26 | C30 | H22 | 65.2° | 64.9° |
| H6 | C28 | C29 | H20 | 81.6° | 41.3° |
| H7 | C28 | C29 | H20 | 39.8° | 80.9° |
| H20 | C29 | C30 | H21 | 64.0° | 64.9° |
| H20 | C29 | C30 | H22 | 60.9° | 62.6° |
| H23 | C34 | H24 | H25 | 120.0° | 120.0° |
