7OE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C16 | doub | 1.39Å | 1.42Å | Aromatic |
| C17 | C18 | sing | 1.36Å | 1.36Å | Aromatic |
| C16 | C08 | sing | 1.39Å | 1.38Å | Aromatic |
| C18 | C19 | doub | 1.41Å | 1.39Å | Aromatic |
| C08 | C06 | sing | 1.48Å | 1.45Å | |
| C08 | C20 | doub | 1.41Å | 1.42Å | Aromatic |
| N03 | C05 | doub | 1.31Å | 1.34Å | Aromatic |
| N03 | C06 | sing | 1.34Å | 1.34Å | Aromatic |
| C05 | C01 | sing | 1.40Å | 1.42Å | Aromatic |
| C06 | C07 | doub | 1.39Å | 1.39Å | Aromatic |
| C19 | C20 | sing | 1.41Å | 1.42Å | Aromatic |
| C19 | C21 | sing | 1.41Å | 1.41Å | Aromatic |
| C20 | C24 | sing | 1.41Å | 1.41Å | Aromatic |
| C13 | N04 | sing | 1.50Å | 1.47Å | |
| C13 | C12 | sing | 1.54Å | 1.54Å | |
| C07 | C02 | sing | 1.40Å | 1.39Å | Aromatic |
| C07 | F01 | sing | 1.35Å | 1.40Å | |
| C01 | C02 | doub | 1.42Å | 1.41Å | Aromatic |
| C01 | C04 | sing | 1.42Å | 1.43Å | Aromatic |
| C29 | N06 | sing | 1.48Å | 1.48Å | |
| C29 | C30 | sing | 1.56Å | 1.50Å | |
| N04 | C04 | sing | 1.38Å | 1.39Å | |
| N04 | C10 | sing | 1.47Å | 1.52Å | |
| C02 | N01 | sing | 1.34Å | 1.38Å | Aromatic |
| C04 | N02 | doub | 1.33Å | 1.33Å | Aromatic |
| C21 | C22 | doub | 1.36Å | 1.35Å | Aromatic |
| N06 | C28 | sing | 1.50Å | 1.51Å | |
| N06 | C25 | sing | 1.48Å | 1.50Å | |
| C10 | C11 | sing | 1.54Å | 1.55Å | |
| C30 | C31 | sing | 1.55Å | 1.57Å | |
| N02 | C03 | sing | 1.33Å | 1.35Å | Aromatic |
| C28 | C27 | sing | 1.55Å | 1.51Å | |
| N01 | C03 | doub | 1.32Å | 1.32Å | Aromatic |
| C03 | O01 | sing | 1.35Å | 1.32Å | |
| C12 | N05 | sing | 1.49Å | 1.52Å | |
| C12 | C14 | sing | 1.55Å | 1.53Å | |
| N05 | C11 | sing | 1.49Å | 1.48Å | |
| C24 | C32 | sing | 1.43Å | 1.46Å | |
| C24 | C23 | doub | 1.39Å | 1.38Å | Aromatic |
| O01 | C09 | sing | 1.43Å | 1.47Å | |
| C11 | C15 | sing | 1.55Å | 1.55Å | |
| C22 | C23 | sing | 1.39Å | 1.40Å | Aromatic |
| C09 | C25 | sing | 1.53Å | 1.53Å | |
| C25 | C31 | sing | 1.54Å | 1.54Å | |
| C25 | C26 | sing | 1.54Å | 1.55Å | |
| C32 | C33 | trip | 1.17Å | 1.19Å | |
| C23 | F23 | sing | 1.35Å | 1.38Å | |
| C27 | C26 | sing | 1.55Å | 1.51Å | |
| C14 | C15 | sing | 1.54Å | 1.53Å | |
| C15 | H1 | sing | 1.09Å | 1.10Å | |
| C15 | H2 | sing | 1.09Å | 1.10Å | |
| C14 | H3 | sing | 1.09Å | 1.10Å | |
| C14 | H4 | sing | 1.09Å | 1.10Å | |
| C16 | H5 | sing | 1.08Å | 1.08Å | |
| C17 | H6 | sing | 1.08Å | 1.08Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C11 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C05 | H13 | sing | 1.08Å | 1.08Å | |
| C09 | H14 | sing | 1.09Å | 1.10Å | |
| C09 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.08Å | 1.08Å | |
| C21 | H17 | sing | 1.08Å | 1.08Å | |
| C22 | H18 | sing | 1.08Å | 1.08Å | |
| C26 | H19 | sing | 1.09Å | 1.10Å | |
| C26 | H20 | sing | 1.09Å | 1.10Å | |
| C27 | H21 | sing | 1.09Å | 1.10Å | |
| C27 | H22 | sing | 1.09Å | 1.10Å | |
| C28 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H26 | sing | 1.09Å | 1.10Å | |
| C30 | H27 | sing | 1.09Å | 1.10Å | |
| C30 | H28 | sing | 1.09Å | 1.10Å | |
| C31 | H29 | sing | 1.09Å | 1.10Å | |
| C31 | H30 | sing | 1.09Å | 1.10Å | |
| C33 | H31 | sing | 1.05Å | 1.06Å | |
| N05 | H32 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | C17 | C18 | 121.8° | 121.1° |
| C17 | C16 | C08 | 119.6° | 120.6° |
| C17 | C16 | H5 | 120.2° | 119.7° |
| C16 | C17 | H6 | 119.1° | 119.4° |
| C17 | C18 | C19 | 119.1° | 120.1° |
| C18 | C17 | H6 | 119.1° | 119.5° |
| C17 | C18 | H16 | 120.4° | 120.0° |
| C16 | C08 | C06 | 116.5° | 120.4° |
| C16 | C08 | C20 | 119.7° | 119.3° |
| C08 | C16 | H5 | 120.2° | 119.7° |
| C18 | C19 | C20 | 120.6° | 119.5° |
| C18 | C19 | C21 | 118.5° | 121.0° |
| C19 | C18 | H16 | 120.5° | 120.0° |
| C06 | C08 | C20 | 123.3° | 120.3° |
| C08 | C06 | N03 | 123.9° | 119.3° |
| C08 | C06 | C07 | 119.2° | 119.3° |
| C08 | C20 | C19 | 118.7° | 119.4° |
| C08 | C20 | C24 | 122.8° | 121.2° |
| C05 | N03 | C06 | 122.4° | 122.5° |
| N03 | C05 | C01 | 122.2° | 120.2° |
| N03 | C05 | H13 | 118.9° | 119.9° |
| N03 | C06 | C07 | 115.5° | 121.4° |
| C05 | C01 | C02 | 117.7° | 119.2° |
| C05 | C01 | C04 | 125.3° | 122.6° |
| C01 | C05 | H13 | 118.9° | 119.9° |
| C06 | C07 | C02 | 126.0° | 118.4° |
| C06 | C07 | F01 | 120.3° | 120.8° |
| C20 | C19 | C21 | 120.4° | 119.5° |
| C19 | C20 | C24 | 118.5° | 119.4° |
| C19 | C21 | C22 | 121.3° | 120.2° |
| C19 | C21 | H17 | 119.3° | 119.9° |
| C20 | C24 | C32 | 127.2° | 120.4° |
| C20 | C24 | C23 | 117.3° | 119.3° |
| N04 | C13 | C12 | 110.5° | 109.0° |
| C13 | N04 | C04 | 120.9° | 111.0° |
| C13 | N04 | C10 | 115.0° | 111.2° |
| N04 | C13 | H7 | 109.2° | 109.5° |
| N04 | C13 | H8 | 109.2° | 109.5° |
| C13 | C12 | N05 | 107.3° | 106.9° |
| C13 | C12 | C14 | 113.9° | 107.6° |
| C12 | C13 | H7 | 109.2° | 109.5° |
| C12 | C13 | H8 | 109.2° | 109.6° |
| C13 | C12 | H9 | 111.0° | 112.3° |
| C02 | C07 | F01 | 113.5° | 120.8° |
| C07 | C02 | C01 | 115.6° | 118.2° |
| C07 | C02 | N01 | 124.3° | 122.8° |
| C02 | C01 | C04 | 116.8° | 118.2° |
| C01 | C02 | N01 | 120.1° | 119.0° |
| C01 | C04 | N04 | 122.3° | 120.9° |
| C01 | C04 | N02 | 122.0° | 118.2° |
| N06 | C29 | C30 | 101.8° | 104.0° |
| C29 | N06 | C28 | 111.5° | 109.7° |
| C29 | N06 | C25 | 110.1° | 109.3° |
| N06 | C29 | H25 | 111.4° | 110.4° |
| N06 | C29 | H26 | 111.4° | 110.4° |
| C29 | C30 | C31 | 105.2° | 102.5° |
| C30 | C29 | H25 | 111.4° | 111.9° |
| C30 | C29 | H26 | 111.3° | 109.5° |
| C29 | C30 | H27 | 110.5° | 111.0° |
| C29 | C30 | H28 | 110.5° | 111.0° |
| C04 | N04 | C10 | 120.7° | 111.0° |
| N04 | C04 | N02 | 115.7° | 120.9° |
| N04 | C10 | C11 | 110.2° | 109.0° |
| N04 | C10 | H11 | 109.3° | 109.6° |
| N04 | C10 | H12 | 109.3° | 109.6° |
| C02 | N01 | C03 | 117.2° | 120.3° |
| C04 | N02 | C03 | 115.7° | 121.6° |
| C21 | C22 | C23 | 116.9° | 121.1° |
| C22 | C21 | H17 | 119.3° | 119.9° |
| C21 | C22 | H18 | 121.6° | 119.5° |
| C28 | N06 | C25 | 106.8° | 107.5° |
| N06 | C28 | C27 | 104.1° | 105.2° |
| N06 | C28 | H23 | 110.8° | 110.4° |
| N06 | C28 | H24 | 110.8° | 110.0° |
| N06 | C25 | C09 | 109.7° | 110.9° |
| N06 | C25 | C31 | 106.0° | 107.3° |
| N06 | C25 | C26 | 105.7° | 107.9° |
| C10 | C11 | N05 | 108.6° | 107.6° |
| C10 | C11 | C15 | 111.7° | 107.6° |
| C10 | C11 | H10 | 110.9° | 112.3° |
| C11 | C10 | H11 | 109.3° | 109.6° |
| C11 | C10 | H12 | 109.3° | 109.5° |
| C30 | C31 | C25 | 102.1° | 103.2° |
| C31 | C30 | H27 | 110.5° | 112.2° |
| C31 | C30 | H28 | 110.5° | 109.0° |
| C30 | C31 | H29 | 111.3° | 110.7° |
| C30 | C31 | H30 | 111.3° | 110.7° |
| N02 | C03 | N01 | 127.9° | 122.8° |
| N02 | C03 | O01 | 116.9° | 118.6° |
| C28 | C27 | C26 | 103.1° | 101.7° |
| C28 | C27 | H21 | 111.1° | 111.0° |
| C28 | C27 | H22 | 111.1° | 111.0° |
| C27 | C28 | H23 | 110.8° | 110.4° |
| C27 | C28 | H24 | 110.8° | 110.3° |
| N01 | C03 | O01 | 115.1° | 118.6° |
| C03 | O01 | C09 | 119.8° | 117.0° |
| N05 | C12 | C14 | 102.1° | 104.0° |
| C12 | N05 | C11 | 102.0° | 103.0° |
| N05 | C12 | H9 | 111.2° | 112.4° |
| C12 | N05 | H32 | 111.3° | 111.1° |
| C12 | C14 | C15 | 105.7° | 104.7° |
| C12 | C14 | H3 | 110.4° | 110.4° |
| C12 | C14 | H4 | 110.4° | 110.5° |
| C14 | C12 | H9 | 111.0° | 113.0° |
| N05 | C11 | C15 | 102.4° | 103.9° |
| N05 | C11 | H10 | 111.9° | 112.5° |
| C11 | N05 | H32 | 111.3° | 111.0° |
| C32 | C24 | C23 | 115.5° | 120.4° |
| C24 | C32 | C33 | 179.5° | 180.0° |
| C24 | C23 | C22 | 125.5° | 120.6° |
| C24 | C23 | F23 | 118.8° | 119.7° |
| O01 | C09 | C25 | 105.9° | 109.5° |
| O01 | C09 | H14 | 110.4° | 109.5° |
| O01 | C09 | H15 | 110.4° | 109.5° |
| C11 | C15 | C14 | 104.6° | 104.8° |
| C11 | C15 | H1 | 110.7° | 110.4° |
| C11 | C15 | H2 | 110.7° | 110.3° |
| C15 | C11 | H10 | 110.9° | 112.4° |
| C22 | C23 | F23 | 115.7° | 119.7° |
| C23 | C22 | H18 | 121.6° | 119.4° |
| C09 | C25 | C31 | 107.6° | 110.8° |
| C09 | C25 | C26 | 112.8° | 110.8° |
| C25 | C09 | H14 | 110.3° | 109.5° |
| C25 | C09 | H15 | 110.4° | 109.4° |
| C31 | C25 | C26 | 114.8° | 109.1° |
| C25 | C31 | H29 | 111.3° | 110.6° |
| C25 | C31 | H30 | 111.3° | 110.6° |
| C25 | C26 | C27 | 105.2° | 103.0° |
| C25 | C26 | H19 | 110.5° | 110.7° |
| C25 | C26 | H20 | 110.5° | 110.7° |
| C32 | C33 | H31 | 180.0° | 180.0° |
| C27 | C26 | H19 | 110.5° | 110.7° |
| C27 | C26 | H20 | 110.5° | 110.8° |
| C26 | C27 | H21 | 111.0° | 111.0° |
| C26 | C27 | H22 | 111.1° | 111.0° |
| C14 | C15 | H1 | 110.7° | 110.4° |
| C14 | C15 | H2 | 110.7° | 110.4° |
| C15 | C14 | H3 | 110.4° | 110.4° |
| C15 | C14 | H4 | 110.4° | 110.3° |
| H1 | C15 | H2 | 109.5° | 110.4° |
| H3 | C14 | H4 | 109.4° | 110.4° |
| H7 | C13 | H8 | 109.5° | 109.6° |
| H11 | C10 | H12 | 109.5° | 109.5° |
| H14 | C09 | H15 | 109.5° | 109.5° |
| H19 | C26 | H20 | 109.5° | 110.7° |
| H21 | C27 | H22 | 109.5° | 110.8° |
| H23 | C28 | H24 | 109.5° | 110.4° |
| H25 | C29 | H26 | 109.5° | 110.4° |
| H27 | C30 | H28 | 109.5° | 110.8° |
| H29 | C31 | H30 | 109.5° | 110.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | C17 | C18 | H6 | 180.0° | 180.0° |
| C17 | C16 | C08 | H5 | 180.0° | 179.7° |
| C16 | C17 | C18 | C19 | 2.6° | 0.0° |
| C17 | C16 | C08 | C06 | 169.4° | 179.8° |
| C17 | C16 | C08 | C20 | 2.8° | 0.3° |
| C16 | C17 | C18 | H16 | 177.4° | 180.0° |
| C18 | C17 | C16 | C08 | 0.7° | 0.0° |
| C17 | C18 | C19 | H16 | 180.0° | 179.9° |
| C17 | C18 | C19 | C20 | 6.6° | 0.3° |
| C17 | C18 | C19 | C21 | 179.0° | 179.9° |
| C18 | C17 | C16 | H5 | 179.3° | 179.8° |
| C16 | C08 | C06 | C20 | 171.9° | 179.9° |
| C16 | C08 | C06 | N03 | 68.9° | 94.6° |
| C16 | C08 | C06 | C07 | 97.2° | 84.8° |
| C16 | C08 | C20 | C19 | 6.7° | 0.6° |
| C16 | C08 | C20 | C24 | 176.8° | 180.0° |
| C08 | C16 | C17 | H6 | 179.3° | 180.0° |
| C18 | C19 | C20 | C08 | 8.7° | 0.6° |
| C18 | C19 | C20 | C21 | 172.2° | 179.8° |
| C18 | C19 | C20 | C24 | 174.7° | 180.0° |
| C18 | C19 | C21 | C22 | 176.3° | 180.0° |
| C19 | C18 | C17 | H6 | 177.4° | 180.0° |
| C18 | C19 | C21 | H17 | 3.7° | 0.1° |
| C08 | C06 | N03 | C05 | 175.3° | 179.7° |
| C08 | C06 | N03 | C07 | 166.5° | 179.4° |
| C06 | C08 | C20 | C19 | 164.9° | 179.5° |
| C06 | C08 | C20 | C24 | 11.6° | 0.1° |
| C08 | C06 | C07 | C02 | 173.9° | 180.0° |
| C08 | C06 | C07 | F01 | 10.7° | 0.6° |
| C06 | C08 | C16 | H5 | 10.6° | 0.0° |
| C20 | C08 | C06 | N03 | 119.2° | 85.3° |
| C20 | C08 | C06 | C07 | 74.7° | 95.3° |
| C08 | C20 | C19 | C24 | 176.6° | 179.4° |
| C08 | C20 | C19 | C21 | 179.1° | 179.6° |
| C08 | C20 | C24 | C32 | 4.9° | 0.0° |
| C08 | C20 | C24 | C23 | 175.8° | 179.3° |
| C20 | C08 | C16 | H5 | 177.2° | 180.0° |
| N03 | C05 | C01 | H13 | 180.0° | 179.9° |
| C05 | N03 | C06 | C07 | 8.7° | 0.9° |
| N03 | C05 | C01 | C02 | 1.8° | 0.1° |
| N03 | C05 | C01 | C04 | 176.9° | 179.7° |
| C06 | N03 | C05 | C01 | 4.9° | 0.6° |
| N03 | C06 | C07 | C02 | 6.6° | 0.6° |
| N03 | C06 | C07 | F01 | 178.0° | 180.0° |
| C06 | N03 | C05 | H13 | 175.0° | 179.5° |
| C05 | C01 | C02 | C07 | 3.8° | 0.2° |
| C05 | C01 | C02 | C04 | 175.5° | 179.8° |
| C05 | C01 | C04 | N04 | 8.3° | 0.2° |
| C05 | C01 | C02 | N01 | 173.4° | 179.7° |
| C05 | C01 | C04 | N02 | 170.1° | 179.8° |
| C06 | C07 | C02 | F01 | 175.7° | 179.4° |
| C06 | C07 | C02 | C01 | 0.4° | 0.1° |
| C06 | C07 | C02 | N01 | 177.4° | 180.0° |
| C20 | C19 | C21 | C22 | 4.0° | 0.2° |
| C19 | C20 | C24 | C32 | 178.6° | 179.4° |
| C19 | C20 | C24 | C23 | 0.7° | 0.1° |
| C20 | C19 | C18 | H16 | 173.4° | 179.7° |
| C20 | C19 | C21 | H17 | 176.0° | 179.7° |
| C21 | C19 | C20 | C24 | 2.5° | 0.2° |
| C19 | C21 | C22 | H17 | 180.0° | 179.9° |
| C19 | C21 | C22 | C23 | 2.0° | 0.1° |
| C21 | C19 | C18 | H16 | 1.0° | 0.0° |
| C19 | C21 | C22 | H18 | 178.0° | 179.9° |
| C20 | C24 | C32 | C23 | 179.3° | 179.3° |
| C20 | C24 | C23 | C22 | 2.8° | 0.4° |
| C20 | C24 | C32 | C33 | 160.7° | 176.1° |
| C20 | C24 | C23 | F23 | 178.3° | 179.9° |
| N04 | C13 | C12 | H7 | 120.1° | 119.8° |
| N04 | C13 | C12 | H8 | 120.1° | 119.8° |
| C13 | N04 | C04 | C01 | 157.8° | 119.2° |
| C13 | N04 | C04 | C10 | 158.3° | 124.2° |
| C13 | N04 | C04 | N02 | 20.6° | 60.8° |
| C13 | N04 | C10 | C11 | 43.4° | 54.8° |
| N04 | C13 | C12 | N05 | 61.5° | 63.5° |
| N04 | C13 | C12 | C14 | 50.7° | 47.7° |
| N04 | C13 | H7 | H8 | 119.5° | 120.2° |
| N04 | C13 | C12 | H9 | 176.8° | 172.7° |
| C13 | N04 | C10 | H11 | 163.5° | 65.1° |
| C13 | N04 | C10 | H12 | 76.7° | 174.6° |
| C12 | C13 | N04 | C04 | 113.4° | 69.0° |
| C12 | C13 | N04 | C10 | 46.0° | 55.1° |
| C13 | C12 | N05 | C14 | 120.0° | 113.7° |
| C13 | C12 | N05 | H9 | 121.5° | 123.6° |
| C13 | C12 | C14 | H9 | 126.1° | 124.6° |
| C13 | C12 | N05 | C11 | 74.0° | 70.9° |
| C13 | C12 | C14 | C15 | 88.0° | 87.3° |
| C13 | C12 | C14 | H3 | 152.6° | 31.6° |
| C13 | C12 | C14 | H4 | 31.5° | 153.9° |
| C12 | C13 | H7 | H8 | 119.6° | 120.3° |
| C13 | C12 | N05 | H32 | 44.8° | 47.9° |
| C07 | C02 | C01 | N01 | 177.2° | 179.9° |
| C07 | C02 | C01 | C04 | 179.3° | 180.0° |
| C07 | C02 | N01 | C03 | 176.2° | 180.0° |
| F01 | C07 | C02 | C01 | 176.1° | 179.5° |
| F01 | C07 | C02 | N01 | 6.9° | 0.6° |
| C02 | C01 | C04 | N04 | 176.6° | 180.0° |
| C02 | C01 | C04 | N02 | 5.0° | 0.0° |
| C01 | C02 | N01 | C03 | 0.7° | 0.0° |
| C02 | C01 | C05 | H13 | 178.2° | 180.0° |
| C01 | C04 | N04 | N02 | 178.5° | 180.0° |
| C01 | C04 | N04 | C10 | 43.9° | 116.6° |
| C04 | C01 | C02 | N01 | 2.1° | 0.0° |
| C01 | C04 | N02 | C03 | 4.7° | 0.0° |
| C04 | C01 | C05 | H13 | 3.2° | 0.2° |
| N06 | C29 | C30 | H25 | 118.8° | 119.2° |
| N06 | C29 | C30 | H26 | 118.8° | 118.0° |
| C29 | N06 | C28 | C25 | 120.3° | 118.8° |
| N06 | C29 | C30 | C31 | 38.8° | 35.8° |
| C29 | N06 | C28 | C27 | 90.4° | 141.9° |
| C29 | N06 | C25 | C09 | 125.7° | 119.6° |
| C29 | N06 | C25 | C31 | 9.8° | 1.6° |
| C29 | N06 | C25 | C26 | 112.5° | 118.9° |
| C29 | N06 | C28 | H23 | 28.7° | 99.0° |
| C29 | N06 | C28 | H24 | 150.4° | 23.1° |
| N06 | C29 | H25 | H26 | 123.6° | 122.4° |
| N06 | C29 | C30 | H27 | 80.5° | 155.8° |
| N06 | C29 | C30 | H28 | 158.1° | 80.5° |
| C30 | C29 | N06 | C28 | 148.8° | 94.2° |
| C30 | C29 | N06 | C25 | 30.4° | 23.5° |
| C29 | C30 | C31 | H27 | 119.3° | 119.2° |
| C29 | C30 | C31 | H28 | 119.3° | 117.6° |
| C29 | C30 | C31 | C25 | 33.1° | 34.4° |
| C30 | C29 | H25 | H26 | 123.5° | 122.2° |
| C29 | C30 | H27 | H28 | 122.0° | 123.8° |
| C29 | C30 | C31 | H29 | 151.9° | 152.8° |
| C29 | C30 | C31 | H30 | 85.7° | 84.0° |
| C04 | N04 | C10 | C11 | 116.1° | 69.3° |
| N04 | C04 | N02 | C03 | 176.8° | 179.9° |
| C04 | N04 | C13 | H7 | 126.5° | 50.8° |
| C04 | N04 | C13 | H8 | 6.7° | 171.0° |
| C04 | N04 | C10 | H11 | 4.0° | 170.8° |
| C04 | N04 | C10 | H12 | 123.8° | 50.5° |
| C10 | N04 | C04 | N02 | 137.6° | 63.4° |
| N04 | C10 | C11 | H11 | 120.1° | 119.9° |
| N04 | C10 | C11 | H12 | 120.1° | 119.9° |
| N04 | C10 | C11 | N05 | 57.2° | 63.8° |
| N04 | C10 | C11 | C15 | 55.1° | 47.6° |
| C10 | N04 | C13 | H7 | 74.1° | 174.9° |
| C10 | N04 | C13 | H8 | 166.2° | 64.9° |
| N04 | C10 | C11 | H10 | 179.4° | 171.8° |
| N04 | C10 | H11 | H12 | 119.7° | 120.3° |
| C02 | N01 | C03 | N02 | 1.1° | 0.0° |
| C02 | N01 | C03 | O01 | 175.2° | 180.0° |
| C04 | N02 | C03 | N01 | 1.7° | 0.1° |
| C04 | N02 | C03 | O01 | 177.9° | 180.0° |
| C21 | C22 | C23 | C24 | 1.5° | 0.4° |
| C21 | C22 | C23 | H18 | 180.0° | 180.0° |
| C21 | C22 | C23 | F23 | 179.6° | 179.9° |
| N06 | C28 | C27 | H23 | 119.1° | 119.1° |
| N06 | C28 | C27 | H24 | 119.1° | 118.6° |
| C28 | N06 | C25 | C09 | 113.2° | 121.4° |
| C28 | N06 | C25 | C31 | 130.9° | 117.5° |
| C28 | N06 | C25 | C26 | 8.7° | 0.1° |
| N06 | C28 | C27 | C26 | 39.2° | 36.7° |
| N06 | C28 | C27 | H21 | 79.8° | 81.4° |
| N06 | C28 | C27 | H22 | 158.2° | 154.9° |
| N06 | C28 | H23 | H24 | 122.5° | 121.8° |
| C28 | N06 | C29 | H25 | 92.5° | 26.0° |
| C28 | N06 | C29 | H26 | 30.0° | 148.4° |
| N06 | C25 | C31 | C30 | 14.1° | 21.1° |
| C25 | N06 | C28 | C27 | 29.8° | 23.2° |
| N06 | C25 | C09 | O01 | 60.7° | 180.0° |
| N06 | C25 | C09 | C31 | 114.9° | 119.0° |
| N06 | C25 | C09 | C26 | 117.5° | 119.8° |
| N06 | C25 | C31 | C26 | 116.2° | 116.6° |
| N06 | C25 | C26 | C27 | 15.7° | 23.1° |
| N06 | C25 | C09 | H14 | 179.8° | 59.9° |
| N06 | C25 | C09 | H15 | 58.7° | 60.1° |
| N06 | C25 | C26 | H19 | 103.7° | 141.4° |
| N06 | C25 | C26 | H20 | 135.0° | 95.5° |
| C25 | N06 | C28 | H23 | 149.0° | 142.2° |
| C25 | N06 | C28 | H24 | 89.3° | 95.7° |
| C25 | N06 | C29 | H25 | 149.2° | 143.7° |
| C25 | N06 | C29 | H26 | 88.3° | 93.9° |
| N06 | C25 | C31 | H29 | 132.9° | 139.6° |
| N06 | C25 | C31 | H30 | 104.7° | 97.3° |
| C10 | C11 | N05 | C12 | 72.0° | 71.2° |
| C10 | C11 | N05 | C15 | 118.3° | 113.9° |
| C10 | C11 | N05 | H10 | 122.9° | 124.2° |
| C10 | C11 | C15 | H10 | 124.3° | 124.2° |
| C10 | C11 | C15 | C14 | 87.3° | 87.9° |
| C10 | C11 | C15 | H1 | 31.9° | 153.2° |
| C10 | C11 | C15 | H2 | 153.5° | 31.0° |
| C11 | C10 | H11 | H12 | 119.7° | 120.2° |
| C10 | C11 | N05 | H32 | 46.8° | 47.7° |
| C30 | C31 | C25 | C09 | 103.2° | 142.2° |
| C30 | C31 | C25 | H29 | 118.8° | 118.5° |
| C30 | C31 | C25 | H30 | 118.8° | 118.4° |
| C30 | C31 | C25 | C26 | 130.3° | 95.5° |
| C31 | C30 | C29 | H25 | 157.5° | 155.0° |
| C31 | C30 | C29 | H26 | 80.0° | 82.2° |
| C31 | C30 | H27 | H28 | 122.0° | 122.1° |
| C30 | C31 | H29 | H30 | 123.4° | 123.2° |
| N02 | C03 | N01 | O01 | 176.3° | 179.9° |
| N02 | C03 | O01 | C09 | 7.2° | 179.9° |
| C28 | C27 | C26 | C25 | 33.8° | 35.8° |
| C28 | C27 | C26 | H21 | 119.0° | 118.1° |
| C28 | C27 | C26 | H22 | 119.0° | 118.2° |
| C28 | C27 | C26 | H19 | 85.5° | 154.2° |
| C28 | C27 | C26 | H20 | 153.1° | 82.6° |
| C28 | C27 | H21 | H22 | 123.0° | 123.8° |
| C27 | C28 | H23 | H24 | 122.5° | 122.2° |
| N01 | C03 | O01 | C09 | 176.1° | 0.0° |
| C03 | O01 | C09 | C25 | 167.8° | 180.0° |
| C03 | O01 | C09 | H14 | 72.8° | 60.0° |
| C03 | O01 | C09 | H15 | 48.3° | 60.0° |
| N05 | C12 | C14 | H9 | 118.6° | 122.3° |
| C12 | N05 | C11 | H32 | 118.8° | 118.9° |
| C12 | N05 | C11 | C15 | 46.3° | 42.8° |
| N05 | C12 | C14 | C15 | 27.3° | 25.9° |
| N05 | C12 | C14 | H3 | 92.1° | 144.7° |
| N05 | C12 | C14 | H4 | 146.8° | 92.9° |
| N05 | C12 | C13 | H7 | 58.6° | 176.6° |
| N05 | C12 | C13 | H8 | 178.3° | 56.3° |
| C12 | N05 | C11 | H10 | 165.2° | 164.6° |
| C14 | C12 | N05 | C11 | 46.0° | 42.8° |
| C12 | C14 | C15 | C11 | 0.4° | 0.1° |
| C12 | C14 | C15 | H3 | 119.4° | 118.8° |
| C12 | C14 | C15 | H4 | 119.4° | 118.9° |
| C12 | C14 | C15 | H1 | 119.7° | 118.8° |
| C12 | C14 | C15 | H2 | 118.8° | 118.9° |
| C12 | C14 | H3 | H4 | 121.8° | 122.4° |
| C14 | C12 | C13 | H7 | 170.8° | 72.1° |
| C14 | C12 | C13 | H8 | 69.4° | 167.5° |
| C14 | C12 | N05 | H32 | 164.8° | 161.6° |
| N05 | C11 | C15 | H10 | 119.6° | 121.9° |
| N05 | C11 | C15 | C14 | 28.8° | 26.0° |
| N05 | C11 | C15 | H1 | 148.0° | 92.9° |
| N05 | C11 | C15 | H2 | 90.4° | 144.8° |
| C11 | N05 | C12 | H9 | 164.5° | 165.4° |
| N05 | C11 | C10 | H11 | 177.3° | 56.1° |
| N05 | C11 | C10 | H12 | 62.9° | 176.3° |
| C32 | C24 | C23 | C22 | 176.6° | 179.7° |
| C32 | C24 | C23 | F23 | 2.3° | 0.7° |
| C24 | C32 | C33 | H31 | 26.9° | 133.6° |
| C24 | C23 | C22 | F23 | 178.9° | 179.6° |
| C23 | C24 | C32 | C33 | 18.6° | 3.2° |
| C24 | C23 | C22 | H18 | 178.5° | 179.6° |
| O01 | C09 | C25 | H14 | 119.4° | 120.0° |
| O01 | C09 | C25 | H15 | 119.5° | 120.0° |
| O01 | C09 | C25 | C31 | 175.6° | 61.0° |
| O01 | C09 | C25 | C26 | 56.8° | 60.2° |
| O01 | C09 | H14 | H15 | 121.7° | 120.0° |
| C11 | C15 | C14 | H1 | 119.2° | 118.9° |
| C11 | C15 | C14 | H2 | 119.2° | 118.8° |
| C11 | C15 | H1 | H2 | 122.3° | 122.2° |
| C11 | C15 | C14 | H3 | 119.9° | 118.7° |
| C11 | C15 | C14 | H4 | 119.0° | 119.0° |
| C15 | C11 | C10 | H11 | 65.0° | 167.5° |
| C15 | C11 | C10 | H12 | 175.2° | 72.3° |
| C15 | C11 | N05 | H32 | 165.1° | 161.7° |
| C23 | C22 | C21 | H17 | 178.0° | 180.0° |
| C09 | C25 | C31 | C26 | 126.4° | 122.2° |
| C09 | C25 | C26 | C27 | 135.5° | 98.5° |
| C25 | C09 | H14 | H15 | 121.6° | 120.0° |
| C09 | C25 | C26 | H19 | 16.2° | 19.9° |
| C09 | C25 | C26 | H20 | 105.2° | 143.0° |
| C09 | C25 | C31 | H29 | 15.5° | 99.3° |
| C09 | C25 | C31 | H30 | 138.0° | 23.8° |
| C31 | C25 | C26 | C27 | 100.8° | 139.3° |
| C31 | C25 | C09 | H14 | 65.0° | 179.0° |
| C31 | C25 | C09 | H15 | 56.1° | 59.0° |
| C31 | C25 | C26 | H19 | 139.9° | 102.3° |
| C31 | C25 | C26 | H20 | 18.6° | 20.8° |
| C25 | C31 | C30 | H27 | 86.2° | 153.5° |
| C25 | C31 | C30 | H28 | 152.4° | 83.3° |
| C25 | C31 | H29 | H30 | 123.4° | 123.0° |
| C25 | C26 | C27 | H19 | 119.3° | 118.4° |
| C25 | C26 | C27 | H20 | 119.3° | 118.4° |
| C26 | C25 | C09 | H14 | 62.7° | 59.8° |
| C26 | C25 | C09 | H15 | 176.2° | 179.8° |
| C25 | C26 | H19 | H20 | 122.0° | 123.1° |
| C25 | C26 | C27 | H21 | 85.2° | 82.3° |
| C25 | C26 | C27 | H22 | 152.8° | 154.0° |
| C26 | C25 | C31 | H29 | 110.9° | 23.0° |
| C26 | C25 | C31 | H30 | 11.5° | 146.0° |
| F23 | C23 | C22 | H18 | 0.4° | 0.1° |
| C27 | C26 | H19 | H20 | 122.0° | 123.3° |
| C26 | C27 | H21 | H22 | 122.9° | 123.9° |
| C26 | C27 | C28 | H23 | 158.3° | 155.9° |
| C26 | C27 | C28 | H24 | 79.9° | 81.9° |
| C14 | C15 | H1 | H2 | 122.3° | 122.3° |
| C15 | C14 | H3 | H4 | 121.8° | 122.3° |
| C15 | C14 | C12 | H9 | 145.9° | 148.1° |
| C14 | C15 | C11 | H10 | 148.4° | 147.9° |
| H1 | C15 | C14 | H3 | 120.9° | 122.4° |
| H1 | C15 | C14 | H4 | 0.3° | 0.1° |
| H1 | C15 | C11 | H10 | 92.4° | 29.0° |
| H2 | C15 | C14 | H3 | 0.7° | 0.1° |
| H2 | C15 | C14 | H4 | 121.8° | 122.2° |
| H2 | C15 | C11 | H10 | 29.1° | 93.2° |
| H3 | C14 | C12 | H9 | 26.5° | 93.0° |
| H4 | C14 | C12 | H9 | 94.6° | 29.3° |
| H5 | C16 | C17 | H6 | 0.7° | 0.3° |
| H6 | C17 | C18 | H16 | 2.6° | 0.1° |
| H7 | C13 | C12 | H9 | 63.0° | 52.9° |
| H8 | C13 | C12 | H9 | 56.7° | 67.4° |
| H9 | C12 | N05 | H32 | 76.7° | 75.7° |
| H10 | C11 | C10 | H11 | 59.3° | 68.3° |
| H10 | C11 | C10 | H12 | 60.5° | 51.9° |
| H10 | C11 | N05 | H32 | 76.0° | 76.5° |
| H17 | C21 | C22 | H18 | 2.0° | 0.0° |
| H19 | C26 | C27 | H21 | 155.5° | 36.1° |
| H19 | C26 | C27 | H22 | 33.4° | 87.6° |
| H20 | C26 | C27 | H21 | 34.1° | 159.3° |
| H20 | C26 | C27 | H22 | 87.9° | 35.6° |
| H21 | C27 | C28 | H23 | 39.4° | 37.8° |
| H21 | C27 | C28 | H24 | 161.1° | 160.0° |
| H22 | C27 | C28 | H23 | 82.7° | 86.0° |
| H22 | C27 | C28 | H24 | 39.0° | 36.2° |
| H25 | C29 | C30 | H27 | 38.2° | 84.9° |
| H25 | C29 | C30 | H28 | 83.2° | 38.8° |
| H26 | C29 | C30 | H27 | 160.7° | 37.9° |
| H26 | C29 | C30 | H28 | 39.3° | 161.6° |
| H27 | C30 | C31 | H29 | 32.6° | 88.0° |
| H27 | C30 | C31 | H30 | 155.0° | 35.1° |
| H28 | C30 | C31 | H29 | 88.8° | 35.1° |
| H28 | C30 | C31 | H30 | 33.6° | 158.3° |
