7Q5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C15 | doub | 1.38Å | 1.50Å | Aromatic |
| C16 | C17 | sing | 1.39Å | 1.52Å | Aromatic |
| O20 | C17 | sing | 1.36Å | 1.39Å | |
| C15 | C08 | sing | 1.40Å | 1.51Å | Aromatic |
| C17 | C18 | doub | 1.39Å | 1.51Å | Aromatic |
| C06 | O07 | sing | 1.48Å | 1.54Å | |
| C06 | C04 | sing | 1.56Å | 1.34Å | |
| C06 | C05 | sing | 1.53Å | 1.46Å | |
| O33 | S32 | doub | 1.42Å | 1.48Å | |
| O07 | C02 | sing | 1.47Å | 1.48Å | |
| C08 | C05 | sing | 1.47Å | 1.49Å | |
| C08 | C19 | doub | 1.40Å | 1.51Å | Aromatic |
| C04 | C03 | sing | 1.55Å | 1.23Å | |
| C18 | C19 | sing | 1.38Å | 1.50Å | Aromatic |
| C05 | C01 | doub | 1.36Å | 1.71Å | |
| O34 | S32 | doub | 1.42Å | 1.46Å | |
| S32 | C03 | sing | 1.81Å | 2.10Å | |
| S32 | N22 | sing | 1.66Å | 1.71Å | |
| C03 | C02 | sing | 1.56Å | 1.39Å | |
| C02 | C01 | sing | 1.53Å | 1.47Å | |
| C01 | C09 | sing | 1.47Å | 1.50Å | |
| F36 | C35 | sing | 1.40Å | 1.37Å | |
| F38 | C35 | sing | 1.40Å | 1.37Å | |
| C24 | N22 | sing | 1.46Å | 1.46Å | |
| C24 | C35 | sing | 1.53Å | 1.50Å | |
| N22 | C23 | sing | 1.39Å | 1.47Å | |
| C35 | F37 | sing | 1.40Å | 1.37Å | |
| C09 | C10 | doub | 1.40Å | 1.52Å | Aromatic |
| C09 | C14 | sing | 1.40Å | 1.50Å | Aromatic |
| C10 | C11 | sing | 1.38Å | 1.51Å | Aromatic |
| C23 | C25 | doub | 1.39Å | 1.53Å | Aromatic |
| C23 | C29 | sing | 1.39Å | 1.53Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.50Å | Aromatic |
| C25 | C26 | sing | 1.37Å | 1.54Å | Aromatic |
| C29 | C28 | doub | 1.37Å | 1.52Å | Aromatic |
| C11 | C12 | doub | 1.39Å | 1.52Å | Aromatic |
| C26 | C27 | doub | 1.40Å | 1.52Å | Aromatic |
| C13 | C12 | sing | 1.39Å | 1.48Å | Aromatic |
| C12 | O21 | sing | 1.36Å | 1.38Å | |
| C28 | C27 | sing | 1.40Å | 1.52Å | Aromatic |
| C27 | C30 | sing | 1.47Å | 1.52Å | |
| C30 | C1 | doub | 1.35Å | 1.31Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C13 | H2 | sing | 1.08Å | 1.08Å | |
| C15 | H3 | sing | 1.08Å | 1.08Å | |
| C24 | H4 | sing | 1.09Å | 1.10Å | |
| C24 | H5 | sing | 1.09Å | 1.10Å | |
| C26 | H6 | sing | 1.08Å | 1.08Å | |
| C28 | H7 | sing | 1.08Å | 1.08Å | |
| C02 | H9 | sing | 1.09Å | 1.10Å | |
| C03 | H10 | sing | 1.09Å | 1.10Å | |
| C04 | H11 | sing | 1.09Å | 1.10Å | |
| C04 | H12 | sing | 1.09Å | 1.10Å | |
| C06 | H14 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.08Å | 1.08Å | |
| C14 | H16 | sing | 1.08Å | 1.08Å | |
| C16 | H17 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| O20 | H20 | sing | 0.97Å | 0.95Å | |
| O21 | H21 | sing | 0.97Å | 0.95Å | |
| C25 | H22 | sing | 1.08Å | 1.08Å | |
| C29 | H23 | sing | 1.08Å | 1.08Å | |
| C30 | H24 | sing | 1.08Å | 1.08Å | |
| C1 | H25 | sing | 1.08Å | 1.08Å | |
| C1 | C2 | sing | 1.42Å | 83.55Å | |
| C2 | O2 | sing | 1.35Å | 0.00Å | |
| O2 | C4 | sing | 1.43Å | 0.00Å | |
| C2 | O1 | doub | 1.22Å | 0.00Å | |
| C4 | H8 | sing | 1.09Å | 0.00Å | |
| C4 | H13 | sing | 1.09Å | 0.00Å | |
| C4 | H26 | sing | 1.09Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C15 | C16 | C17 | 118.2° | 120.1° |
| C16 | C15 | C08 | 117.4° | 119.9° |
| C16 | C15 | H3 | 121.3° | 120.1° |
| C15 | C16 | H17 | 120.9° | 119.9° |
| C16 | C17 | O20 | 117.0° | 119.9° |
| C16 | C17 | C18 | 123.2° | 120.3° |
| C17 | C16 | H17 | 120.9° | 119.9° |
| O20 | C17 | C18 | 119.7° | 119.8° |
| C17 | O20 | H20 | 109.5° | 114.0° |
| C15 | C08 | C05 | 115.8° | 120.1° |
| C15 | C08 | C19 | 125.2° | 119.8° |
| C08 | C15 | H3 | 121.3° | 120.0° |
| C17 | C18 | C19 | 118.9° | 120.1° |
| C17 | C18 | H18 | 120.5° | 120.0° |
| O07 | C06 | C04 | 96.5° | 101.5° |
| O07 | C06 | C05 | 101.2° | 100.1° |
| C06 | O07 | C02 | 94.5° | 96.3° |
| O07 | C06 | H14 | 114.8° | 115.9° |
| C04 | C06 | C05 | 106.2° | 105.6° |
| C06 | C04 | C03 | 106.7° | 101.9° |
| C06 | C04 | H11 | 110.2° | 110.9° |
| C06 | C04 | H12 | 110.2° | 110.9° |
| C04 | C06 | H14 | 118.8° | 115.8° |
| C06 | C05 | C08 | 124.3° | 127.0° |
| C06 | C05 | C01 | 103.7° | 106.0° |
| C05 | C06 | H14 | 116.3° | 115.8° |
| O33 | S32 | O34 | 107.5° | 121.0° |
| O33 | S32 | C03 | 111.6° | 110.6° |
| O33 | S32 | N22 | 114.2° | 104.2° |
| O07 | C02 | C03 | 95.0° | 101.8° |
| O07 | C02 | C01 | 99.3° | 100.7° |
| O07 | C02 | H9 | 114.9° | 115.9° |
| C05 | C08 | C19 | 119.0° | 120.1° |
| C08 | C05 | C01 | 129.3° | 127.0° |
| C08 | C19 | C18 | 117.0° | 119.9° |
| C08 | C19 | H19 | 121.5° | 120.1° |
| C04 | C03 | S32 | 105.8° | 111.0° |
| C04 | C03 | C02 | 114.9° | 101.9° |
| C04 | C03 | H10 | 114.9° | 110.9° |
| C03 | C04 | H11 | 110.1° | 110.9° |
| C03 | C04 | H12 | 110.1° | 110.9° |
| C19 | C18 | H18 | 120.6° | 119.9° |
| C18 | C19 | H19 | 121.5° | 120.0° |
| C05 | C01 | C02 | 94.4° | 105.9° |
| C05 | C01 | C09 | 125.1° | 127.0° |
| O34 | S32 | C03 | 103.5° | 110.6° |
| O34 | S32 | N22 | 119.7° | 104.3° |
| C03 | S32 | N22 | 99.4° | 104.5° |
| S32 | C03 | C02 | 103.5° | 111.0° |
| S32 | C03 | H10 | 104.3° | 110.8° |
| S32 | N22 | C24 | 117.7° | 120.0° |
| S32 | N22 | C23 | 115.0° | 120.0° |
| C03 | C02 | C01 | 113.1° | 105.1° |
| C03 | C02 | H9 | 116.5° | 115.6° |
| C02 | C03 | H10 | 111.9° | 110.9° |
| C02 | C01 | C09 | 123.4° | 127.1° |
| C01 | C02 | H9 | 115.0° | 115.6° |
| C01 | C09 | C10 | 125.4° | 120.1° |
| C01 | C09 | C14 | 113.4° | 120.1° |
| F36 | C35 | F38 | 109.7° | 109.4° |
| F36 | C35 | C24 | 107.7° | 109.5° |
| F36 | C35 | F37 | 113.4° | 109.4° |
| F38 | C35 | C24 | 110.1° | 109.4° |
| F38 | C35 | F37 | 111.9° | 109.5° |
| N22 | C24 | C35 | 112.1° | 109.4° |
| C24 | N22 | C23 | 126.4° | 120.0° |
| N22 | C24 | H4 | 108.8° | 109.5° |
| N22 | C24 | H5 | 108.8° | 109.5° |
| C24 | C35 | F37 | 103.9° | 109.5° |
| C35 | C24 | H4 | 108.8° | 109.4° |
| C35 | C24 | H5 | 108.8° | 109.5° |
| N22 | C23 | C25 | 121.9° | 119.9° |
| N22 | C23 | C29 | 118.4° | 119.9° |
| C10 | C09 | C14 | 121.2° | 119.8° |
| C09 | C10 | C11 | 119.4° | 119.9° |
| C09 | C10 | H1 | 120.3° | 120.1° |
| C09 | C14 | C13 | 118.8° | 119.9° |
| C09 | C14 | H16 | 120.6° | 120.0° |
| C10 | C11 | C12 | 118.6° | 120.1° |
| C11 | C10 | H1 | 120.3° | 120.1° |
| C10 | C11 | H15 | 120.8° | 119.9° |
| C25 | C23 | C29 | 119.5° | 120.2° |
| C23 | C25 | C26 | 120.6° | 120.1° |
| C23 | C25 | H22 | 119.7° | 120.0° |
| C23 | C29 | C28 | 119.9° | 120.1° |
| C23 | C29 | H23 | 120.0° | 120.0° |
| C14 | C13 | C12 | 121.1° | 120.1° |
| C14 | C13 | H2 | 119.5° | 120.0° |
| C13 | C14 | H16 | 120.6° | 120.1° |
| C25 | C26 | C27 | 119.0° | 119.9° |
| C25 | C26 | H6 | 120.5° | 120.1° |
| C26 | C25 | H22 | 119.7° | 119.9° |
| C29 | C28 | C27 | 120.3° | 119.9° |
| C29 | C28 | H7 | 119.8° | 120.1° |
| C28 | C29 | H23 | 120.0° | 119.9° |
| C11 | C12 | C13 | 120.9° | 120.3° |
| C11 | C12 | O21 | 120.4° | 119.9° |
| C12 | C11 | H15 | 120.7° | 120.0° |
| C26 | C27 | C28 | 120.6° | 119.8° |
| C26 | C27 | C30 | 122.0° | 120.1° |
| C27 | C26 | H6 | 120.5° | 120.0° |
| C13 | C12 | O21 | 118.7° | 119.9° |
| C12 | C13 | H2 | 119.5° | 119.9° |
| C12 | O21 | H21 | 109.5° | 114.0° |
| C28 | C27 | C30 | 117.4° | 120.1° |
| C27 | C28 | H7 | 119.9° | 120.0° |
| C27 | C30 | C1 | 117.4° | 120.0° |
| C27 | C30 | H24 | 121.3° | 120.0° |
| C1 | C30 | H24 | 121.3° | 120.0° |
| C30 | C1 | H25 | 159.0° | 120.0° |
| C30 | C1 | C2 | 41.9° | 120.0° |
| H4 | C24 | H5 | 109.4° | 109.5° |
| H11 | C04 | H12 | 109.5° | 110.9° |
| H25 | C1 | C2 | 159.1° | 120.0° |
| C1 | C2 | O2 | 90.0° | 120.0° |
| C1 | C2 | O1 | 90.0° | 120.0° |
| C2 | O2 | C4 | 90.0° | 117.0° |
| O2 | C2 | O1 | 90.0° | 120.0° |
| O2 | C4 | H8 | 90.0° | 109.5° |
| O2 | C4 | H13 | 90.0° | 109.4° |
| O2 | C4 | H26 | 90.0° | 109.5° |
| H8 | C4 | H13 | 90.0° | 109.5° |
| H8 | C4 | H26 | 90.0° | 109.4° |
| H13 | C4 | H26 | 90.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C15 | C16 | C17 | H17 | 180.0° | 180.0° |
| C15 | C16 | C17 | O20 | 179.3° | 179.8° |
| C16 | C15 | C08 | H3 | 180.0° | 179.8° |
| C15 | C16 | C17 | C18 | 1.5° | 0.6° |
| C16 | C15 | C08 | C05 | 179.5° | 179.7° |
| C16 | C15 | C08 | C19 | 0.2° | 0.2° |
| C16 | C17 | O20 | C18 | 177.9° | 179.2° |
| C17 | C16 | C15 | C08 | 0.2° | 0.0° |
| C16 | C17 | C18 | C19 | 2.4° | 0.9° |
| C17 | C16 | C15 | H3 | 179.8° | 179.7° |
| C16 | C17 | C18 | H18 | 177.6° | 180.0° |
| C16 | C17 | O20 | H20 | 180.0° | 90.8° |
| O20 | C17 | C18 | C19 | 179.8° | 180.0° |
| O20 | C17 | C16 | H17 | 0.7° | 0.2° |
| O20 | C17 | C18 | H18 | 0.2° | 0.8° |
| C15 | C08 | C05 | C06 | 31.7° | 116.2° |
| C15 | C08 | C05 | C19 | 179.8° | 179.9° |
| C15 | C08 | C19 | C18 | 0.7° | 0.0° |
| C15 | C08 | C05 | C01 | 169.9° | 65.0° |
| C08 | C15 | C16 | H17 | 179.8° | 179.9° |
| C15 | C08 | C19 | H19 | 179.3° | 180.0° |
| C17 | C18 | C19 | C08 | 1.9° | 0.6° |
| C17 | C18 | C19 | H18 | 180.0° | 179.1° |
| C18 | C17 | C16 | H17 | 178.5° | 179.4° |
| C17 | C18 | C19 | H19 | 178.1° | 179.5° |
| C18 | C17 | O20 | H20 | 2.1° | 90.0° |
| O07 | C06 | C04 | C05 | 103.7° | 104.0° |
| O07 | C06 | C04 | H14 | 123.0° | 126.4° |
| O07 | C06 | C05 | H14 | 125.1° | 125.5° |
| O07 | C06 | C05 | C08 | 141.2° | 147.8° |
| O07 | C06 | C04 | C03 | 41.0° | 34.6° |
| O07 | C06 | C05 | C01 | 21.8° | 33.2° |
| C06 | O07 | C02 | C03 | 45.5° | 56.9° |
| C06 | O07 | C02 | C01 | 68.9° | 51.2° |
| C06 | O07 | C02 | H9 | 167.8° | 176.8° |
| O07 | C06 | C04 | H11 | 160.5° | 83.6° |
| O07 | C06 | C04 | H12 | 78.6° | 152.8° |
| C04 | C06 | C05 | H14 | 134.7° | 129.5° |
| C04 | C06 | O07 | C02 | 54.1° | 56.8° |
| C04 | C06 | C05 | C08 | 118.6° | 107.2° |
| C06 | C04 | C03 | H11 | 119.6° | 118.1° |
| C06 | C04 | C03 | H12 | 119.5° | 118.2° |
| C04 | C06 | C05 | C01 | 78.4° | 71.8° |
| C06 | C04 | C03 | S32 | 124.6° | 118.2° |
| C06 | C04 | C03 | C02 | 11.0° | 0.0° |
| C06 | C04 | C03 | H10 | 121.0° | 118.1° |
| C06 | C04 | H11 | H12 | 121.3° | 123.7° |
| C05 | C06 | O07 | C02 | 53.9° | 51.5° |
| C06 | C05 | C08 | C01 | 158.4° | 178.8° |
| C06 | C05 | C08 | C19 | 148.0° | 63.9° |
| C05 | C06 | C04 | C03 | 62.7° | 69.4° |
| C06 | C05 | C01 | C02 | 17.5° | 0.7° |
| C06 | C05 | C01 | C09 | 154.4° | 179.0° |
| C05 | C06 | C04 | H11 | 56.8° | 172.4° |
| C05 | C06 | C04 | H12 | 177.8° | 48.7° |
| O33 | S32 | C03 | C04 | 46.9° | 41.6° |
| O33 | S32 | O34 | C03 | 118.2° | 131.5° |
| O33 | S32 | O34 | N22 | 132.5° | 116.7° |
| O33 | S32 | C03 | N22 | 120.8° | 111.6° |
| O33 | S32 | C03 | C02 | 74.3° | 71.0° |
| O33 | S32 | N22 | C24 | 1.5° | 163.4° |
| O33 | S32 | N22 | C23 | 171.7° | 16.7° |
| O33 | S32 | C03 | H10 | 168.5° | 165.3° |
| O07 | C02 | C03 | C04 | 26.0° | 35.0° |
| O07 | C02 | C01 | C05 | 51.8° | 32.4° |
| O07 | C02 | C03 | S32 | 88.9° | 83.2° |
| O07 | C02 | C03 | C01 | 102.4° | 104.7° |
| O07 | C02 | C03 | H9 | 121.1° | 126.5° |
| O07 | C02 | C01 | H9 | 123.2° | 125.8° |
| O07 | C02 | C01 | C09 | 170.2° | 147.9° |
| O07 | C02 | C03 | H10 | 159.4° | 153.2° |
| C02 | O07 | C06 | H14 | 180.0° | 176.9° |
| C05 | C08 | C19 | C18 | 179.6° | 180.0° |
| C08 | C05 | C01 | C02 | 179.2° | 179.7° |
| C08 | C05 | C01 | C09 | 43.9° | 0.0° |
| C05 | C08 | C15 | H3 | 0.5° | 0.1° |
| C08 | C05 | C06 | H14 | 16.1° | 22.4° |
| C05 | C08 | C19 | H19 | 0.4° | 0.1° |
| C08 | C19 | C18 | H19 | 180.0° | 179.9° |
| C19 | C08 | C05 | C01 | 10.4° | 114.9° |
| C19 | C08 | C15 | H3 | 179.8° | 180.0° |
| C08 | C19 | C18 | H18 | 178.1° | 179.7° |
| C04 | C03 | S32 | O34 | 68.4° | 178.3° |
| C04 | C03 | S32 | C02 | 121.2° | 112.6° |
| C04 | C03 | S32 | H10 | 121.6° | 123.7° |
| C04 | C03 | S32 | N22 | 167.8° | 70.0° |
| C04 | C03 | C02 | H10 | 133.4° | 118.2° |
| C04 | C03 | C02 | C01 | 76.4° | 69.6° |
| C04 | C03 | C02 | H9 | 147.1° | 161.6° |
| C03 | C04 | H11 | H12 | 121.3° | 123.7° |
| C03 | C04 | C06 | H14 | 163.9° | 161.0° |
| C05 | C01 | C02 | C03 | 47.8° | 73.1° |
| C05 | C01 | C02 | C09 | 138.0° | 179.7° |
| C05 | C01 | C09 | C10 | 18.3° | 64.7° |
| C05 | C01 | C09 | C14 | 160.0° | 115.3° |
| C05 | C01 | C02 | H9 | 175.0° | 158.2° |
| C01 | C05 | C06 | H14 | 146.9° | 158.7° |
| O34 | S32 | C03 | N22 | 123.8° | 111.6° |
| O34 | S32 | C03 | C02 | 170.4° | 65.8° |
| O34 | S32 | N22 | C24 | 131.1° | 35.6° |
| O34 | S32 | N22 | C23 | 58.7° | 144.5° |
| O34 | S32 | C03 | H10 | 53.2° | 58.0° |
| S32 | C03 | C02 | H10 | 111.7° | 123.6° |
| S32 | C03 | C02 | C01 | 168.7° | 172.2° |
| C03 | S32 | N22 | C24 | 117.4° | 80.5° |
| C03 | S32 | N22 | C23 | 52.8° | 99.4° |
| S32 | C03 | C02 | H9 | 32.2° | 43.4° |
| S32 | C03 | C04 | H11 | 115.9° | 0.1° |
| S32 | C03 | C04 | H12 | 5.0° | 123.6° |
| N22 | S32 | C03 | C02 | 46.6° | 177.4° |
| S32 | N22 | C24 | C23 | 169.0° | 179.9° |
| S32 | N22 | C24 | C35 | 99.4° | 97.3° |
| S32 | N22 | C23 | C25 | 36.3° | 102.1° |
| S32 | N22 | C23 | C29 | 138.2° | 77.3° |
| S32 | N22 | C24 | H4 | 21.0° | 22.7° |
| S32 | N22 | C24 | H5 | 140.2° | 142.8° |
| N22 | S32 | C03 | H10 | 70.6° | 53.7° |
| C03 | C02 | C01 | H9 | 137.2° | 128.8° |
| C03 | C02 | C01 | C09 | 90.2° | 106.6° |
| C02 | C03 | C04 | H11 | 130.5° | 118.1° |
| C02 | C03 | C04 | H12 | 108.5° | 118.2° |
| C02 | C01 | C09 | C10 | 107.0° | 115.0° |
| C02 | C01 | C09 | C14 | 74.7° | 65.0° |
| C01 | C02 | C03 | H10 | 57.0° | 48.5° |
| C01 | C09 | C10 | C14 | 178.1° | 180.0° |
| C01 | C09 | C10 | C11 | 179.4° | 180.0° |
| C01 | C09 | C14 | C13 | 180.0° | 179.5° |
| C01 | C09 | C10 | H1 | 0.6° | 0.3° |
| C09 | C01 | C02 | H9 | 47.0° | 22.1° |
| C01 | C09 | C14 | H16 | 0.1° | 0.0° |
| F36 | C35 | F38 | C24 | 118.3° | 120.0° |
| F36 | C35 | F38 | F37 | 126.7° | 120.0° |
| F36 | C35 | C24 | N22 | 50.5° | 56.5° |
| F36 | C35 | C24 | F37 | 120.5° | 120.0° |
| F36 | C35 | C24 | H4 | 69.9° | 176.4° |
| F36 | C35 | C24 | H5 | 170.9° | 63.6° |
| F38 | C35 | C24 | N22 | 170.0° | 176.4° |
| F38 | C35 | C24 | F37 | 120.0° | 120.1° |
| F38 | C35 | C24 | H4 | 49.6° | 63.7° |
| F38 | C35 | C24 | H5 | 69.6° | 56.4° |
| N22 | C24 | C35 | H4 | 120.4° | 119.9° |
| N22 | C24 | C35 | H5 | 120.4° | 120.0° |
| N22 | C24 | C35 | F37 | 70.0° | 63.5° |
| C24 | N22 | C23 | C25 | 154.4° | 77.8° |
| C24 | N22 | C23 | C29 | 31.1° | 102.8° |
| N22 | C24 | H4 | H5 | 118.8° | 120.1° |
| C35 | C24 | N22 | C23 | 91.6° | 82.8° |
| C35 | C24 | H4 | H5 | 118.8° | 120.0° |
| N22 | C23 | C25 | C29 | 174.4° | 179.4° |
| N22 | C23 | C25 | C26 | 176.8° | 179.9° |
| N22 | C23 | C29 | C28 | 177.3° | 179.8° |
| C23 | N22 | C24 | H4 | 147.9° | 157.2° |
| C23 | N22 | C24 | H5 | 28.8° | 37.1° |
| N22 | C23 | C25 | H22 | 3.3° | 0.0° |
| N22 | C23 | C29 | H23 | 2.7° | 0.1° |
| F37 | C35 | C24 | H4 | 169.6° | 56.4° |
| F37 | C35 | C24 | H5 | 50.4° | 176.4° |
| C09 | C10 | C11 | H1 | 180.0° | 179.7° |
| C10 | C09 | C14 | C13 | 1.7° | 0.5° |
| C09 | C10 | C11 | C12 | 0.9° | 0.3° |
| C09 | C10 | C11 | H15 | 179.1° | 179.7° |
| C10 | C09 | C14 | H16 | 178.2° | 180.0° |
| C14 | C09 | C10 | C11 | 1.3° | 0.0° |
| C09 | C14 | C13 | H16 | 180.0° | 179.5° |
| C09 | C14 | C13 | C12 | 1.8° | 0.8° |
| C14 | C09 | C10 | H1 | 178.8° | 179.8° |
| C09 | C14 | C13 | H2 | 178.1° | 179.8° |
| C10 | C11 | C12 | H15 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 1.0° | 0.0° |
| C10 | C11 | C12 | O21 | 179.7° | 179.4° |
| C23 | C25 | C26 | H22 | 180.0° | 179.9° |
| C25 | C23 | C29 | C28 | 2.7° | 0.8° |
| C23 | C25 | C26 | C27 | 1.1° | 0.1° |
| C23 | C25 | C26 | H6 | 178.9° | 179.7° |
| C25 | C23 | C29 | H23 | 177.3° | 179.5° |
| C29 | C23 | C25 | C26 | 2.3° | 0.5° |
| C23 | C29 | C28 | H23 | 180.0° | 179.7° |
| C23 | C29 | C28 | C27 | 1.9° | 0.5° |
| C23 | C29 | C28 | H7 | 178.1° | 179.4° |
| C29 | C23 | C25 | H22 | 177.7° | 179.4° |
| C14 | C13 | C12 | C11 | 1.5° | 0.5° |
| C14 | C13 | C12 | H2 | 180.0° | 179.5° |
| C14 | C13 | C12 | O21 | 179.2° | 179.9° |
| C25 | C26 | C27 | H6 | 180.0° | 179.7° |
| C25 | C26 | C27 | C28 | 0.3° | 0.4° |
| C25 | C26 | C27 | C30 | 179.0° | 179.7° |
| C29 | C28 | C27 | C26 | 0.7° | 0.1° |
| C29 | C28 | C27 | H7 | 180.0° | 179.9° |
| C29 | C28 | C27 | C30 | 179.4° | 180.0° |
| C11 | C12 | C13 | O21 | 179.3° | 179.4° |
| C12 | C11 | C10 | H1 | 179.1° | 180.0° |
| C11 | C12 | C13 | H2 | 178.4° | 180.0° |
| C11 | C12 | O21 | H21 | 180.0° | 90.5° |
| C26 | C27 | C28 | C30 | 178.7° | 179.9° |
| C26 | C27 | C30 | C1 | 114.8° | 43.2° |
| C26 | C27 | C28 | H7 | 179.3° | 180.0° |
| C27 | C26 | C25 | H22 | 178.9° | 180.0° |
| C26 | C27 | C30 | H24 | 65.2° | 136.8° |
| C13 | C12 | C11 | H15 | 179.0° | 180.0° |
| C12 | C13 | C14 | H16 | 178.1° | 179.7° |
| C13 | C12 | O21 | H21 | 0.7° | 90.0° |
| O21 | C12 | C13 | H2 | 0.8° | 0.6° |
| O21 | C12 | C11 | H15 | 0.3° | 0.6° |
| C28 | C27 | C30 | C1 | 63.9° | 136.8° |
| C28 | C27 | C26 | H6 | 179.7° | 180.0° |
| C27 | C28 | C29 | H23 | 178.1° | 179.8° |
| C28 | C27 | C30 | H24 | 116.1° | 43.3° |
| C27 | C30 | C1 | H24 | 180.0° | 180.0° |
| C30 | C27 | C26 | H6 | 1.0° | 0.0° |
| C30 | C27 | C28 | H7 | 0.6° | 0.1° |
| C27 | C30 | C1 | H25 | 166.8° | 168.4° |
| C27 | C30 | C1 | C2 | 13.3° | 11.6° |
| C30 | C1 | H25 | C2 | 180.0° | 180.0° |
| C30 | C1 | C2 | O2 | 90.0° | 173.6° |
| C30 | C1 | C2 | O1 | 90.0° | 6.3° |
| H1 | C10 | C11 | H15 | 0.9° | 0.0° |
| H2 | C13 | C14 | H16 | 1.9° | 0.2° |
| H3 | C15 | C16 | H17 | 0.2° | 0.3° |
| H6 | C26 | C25 | H22 | 1.1° | 0.3° |
| H7 | C28 | C29 | H23 | 1.9° | 0.3° |
| H9 | C02 | C03 | H10 | 79.5° | 80.3° |
| H10 | C03 | C04 | H11 | 1.4° | 123.7° |
| H10 | C03 | C04 | H12 | 119.5° | 0.0° |
| H11 | C04 | C06 | H14 | 76.5° | 42.8° |
| H12 | C04 | C06 | H14 | 44.4° | 80.8° |
| H18 | C18 | C19 | H19 | 1.9° | 0.3° |
| H24 | C30 | C1 | H25 | 13.2° | 11.5° |
| H24 | C30 | C1 | C2 | 166.8° | 168.5° |
| H25 | C1 | C2 | O2 | 90.0° | 6.3° |
| H25 | C1 | C2 | O1 | 90.0° | 173.7° |
| C1 | C2 | O2 | O1 | 90.0° | 180.0° |
| C1 | C2 | O2 | C4 | 90.0° | 180.0° |
| C2 | O2 | C4 | H8 | 90.0° | 60.0° |
| C2 | O2 | C4 | H13 | 90.0° | 180.0° |
| C2 | O2 | C4 | H26 | 90.0° | 60.0° |
| C4 | O2 | C2 | O1 | 90.0° | 0.0° |
| O2 | C4 | H8 | H13 | 90.0° | 120.0° |
| O2 | C4 | H8 | H26 | 90.0° | 120.0° |
| O2 | C4 | H13 | H26 | 90.0° | 120.0° |
| H8 | C4 | H13 | H26 | 90.0° | 120.0° |
