D7J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | C21 | sing | 1.53Å | 1.54Å | |
| O19 | C18 | doub | 1.22Å | 1.21Å | |
| C14 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C23 | C21 | sing | 1.53Å | 1.53Å | |
| C13 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | sing | 1.53Å | 1.57Å | |
| C21 | O20 | sing | 1.45Å | 1.48Å | |
| C18 | O20 | sing | 1.35Å | 1.42Å | |
| C18 | N17 | sing | 1.35Å | 1.44Å | |
| C15 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C11 | doub | 1.38Å | 1.40Å | Aromatic |
| C16 | C11 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | C10 | sing | 1.51Å | 1.48Å | |
| N17 | C09 | sing | 1.46Å | 1.57Å | |
| C10 | C09 | sing | 1.53Å | 1.58Å | |
| C09 | C08 | sing | 1.53Å | 1.53Å | |
| C32 | C31 | doub | 1.38Å | 1.43Å | Aromatic |
| C32 | N33 | sing | 1.32Å | 1.29Å | Aromatic |
| C31 | C30 | sing | 1.39Å | 1.35Å | Aromatic |
| C08 | S07 | sing | 1.81Å | 1.83Å | |
| N33 | C34 | doub | 1.32Å | 1.39Å | Aromatic |
| C30 | C29 | doub | 1.39Å | 1.35Å | Aromatic |
| S07 | C06 | sing | 1.81Å | 1.85Å | |
| C34 | C29 | sing | 1.38Å | 1.36Å | Aromatic |
| C29 | C28 | sing | 1.51Å | 1.50Å | |
| C05 | C06 | sing | 1.53Å | 1.51Å | |
| C05 | N04 | sing | 1.47Å | 1.45Å | |
| C05 | C25 | sing | 1.51Å | 1.60Å | |
| N27 | C28 | sing | 1.47Å | 1.44Å | |
| N27 | C25 | sing | 1.35Å | 1.37Å | |
| N04 | C02 | sing | 1.47Å | 1.39Å | |
| C25 | O26 | doub | 1.21Å | 1.20Å | |
| C01 | C02 | sing | 1.53Å | 1.47Å | |
| C02 | C03 | sing | 1.53Å | 1.44Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C02 | H4 | sing | 1.09Å | 1.10Å | |
| C03 | H5 | sing | 1.09Å | 1.10Å | |
| C03 | H6 | sing | 1.09Å | 1.10Å | |
| C03 | H7 | sing | 1.09Å | 1.10Å | |
| C05 | H8 | sing | 1.09Å | 1.10Å | |
| C06 | H9 | sing | 1.09Å | 1.10Å | |
| C06 | H10 | sing | 1.09Å | 1.10Å | |
| C08 | H11 | sing | 1.09Å | 1.10Å | |
| C08 | H12 | sing | 1.09Å | 1.10Å | |
| C09 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H16 | sing | 1.08Å | 1.08Å | |
| C13 | H17 | sing | 1.08Å | 1.08Å | |
| C14 | H18 | sing | 1.08Å | 1.08Å | |
| C15 | H19 | sing | 1.08Å | 1.08Å | |
| C16 | H20 | sing | 1.08Å | 1.08Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C24 | H27 | sing | 1.09Å | 1.10Å | |
| C24 | H28 | sing | 1.09Å | 1.10Å | |
| C24 | H29 | sing | 1.09Å | 1.10Å | |
| C28 | H30 | sing | 1.09Å | 1.10Å | |
| C28 | H31 | sing | 1.09Å | 1.10Å | |
| C30 | H32 | sing | 1.08Å | 1.08Å | |
| C31 | H33 | sing | 1.08Å | 1.08Å | |
| C32 | H34 | sing | 1.08Å | 1.08Å | |
| C34 | H35 | sing | 1.08Å | 1.08Å | |
| N04 | H36 | sing | 1.01Å | 1.00Å | |
| N17 | H38 | sing | 0.97Å | 1.00Å | |
| N27 | H39 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | C21 | C23 | 111.5° | 109.4° |
| C24 | C21 | C22 | 108.2° | 109.5° |
| C24 | C21 | O20 | 108.5° | 109.5° |
| C21 | C24 | H27 | 109.5° | 109.5° |
| C21 | C24 | H28 | 109.5° | 109.5° |
| C21 | C24 | H29 | 109.5° | 109.5° |
| O19 | C18 | O20 | 119.2° | 120.0° |
| O19 | C18 | N17 | 120.0° | 120.0° |
| C13 | C14 | C15 | 118.9° | 120.0° |
| C14 | C13 | C12 | 120.4° | 119.9° |
| C14 | C13 | H17 | 119.8° | 120.0° |
| C13 | C14 | H18 | 120.5° | 120.0° |
| C14 | C15 | C16 | 120.3° | 120.0° |
| C15 | C14 | H18 | 120.5° | 120.0° |
| C14 | C15 | H19 | 119.9° | 120.0° |
| C23 | C21 | C22 | 106.7° | 109.5° |
| C23 | C21 | O20 | 113.7° | 109.5° |
| C21 | C23 | H24 | 109.5° | 109.5° |
| C21 | C23 | H25 | 109.5° | 109.5° |
| C21 | C23 | H26 | 109.5° | 109.4° |
| C13 | C12 | C11 | 122.3° | 120.0° |
| C13 | C12 | H16 | 118.9° | 120.0° |
| C12 | C13 | H17 | 119.8° | 120.1° |
| C22 | C21 | O20 | 108.2° | 109.5° |
| C21 | C22 | H21 | 109.5° | 109.5° |
| C21 | C22 | H22 | 109.5° | 109.5° |
| C21 | C22 | H23 | 109.5° | 109.4° |
| C21 | O20 | C18 | 121.1° | 117.0° |
| O20 | C18 | N17 | 114.1° | 120.0° |
| C18 | N17 | C09 | 131.2° | 120.0° |
| C18 | N17 | H38 | 114.4° | 120.0° |
| C15 | C16 | C11 | 121.4° | 120.0° |
| C16 | C15 | H19 | 119.9° | 120.0° |
| C15 | C16 | H20 | 119.3° | 120.0° |
| C12 | C11 | C16 | 116.7° | 120.0° |
| C12 | C11 | C10 | 120.2° | 119.9° |
| C11 | C12 | H16 | 118.8° | 120.0° |
| C16 | C11 | C10 | 123.1° | 120.1° |
| C11 | C16 | H20 | 119.3° | 120.0° |
| C11 | C10 | C09 | 118.1° | 109.5° |
| C11 | C10 | H14 | 107.3° | 109.5° |
| C11 | C10 | H15 | 107.3° | 109.4° |
| N17 | C09 | C10 | 119.3° | 109.5° |
| N17 | C09 | C08 | 113.3° | 109.4° |
| N17 | C09 | H13 | 104.0° | 109.5° |
| C09 | N17 | H38 | 114.4° | 120.0° |
| C10 | C09 | C08 | 110.1° | 109.5° |
| C10 | C09 | H13 | 103.9° | 109.5° |
| C09 | C10 | H14 | 107.3° | 109.5° |
| C09 | C10 | H15 | 107.3° | 109.5° |
| C09 | C08 | S07 | 110.9° | 109.5° |
| C09 | C08 | H11 | 109.1° | 109.5° |
| C09 | C08 | H12 | 109.1° | 109.5° |
| C08 | C09 | H13 | 104.4° | 109.5° |
| C31 | C32 | N33 | 120.0° | 120.7° |
| C32 | C31 | C30 | 118.5° | 119.2° |
| C32 | C31 | H33 | 120.8° | 120.4° |
| C31 | C32 | H34 | 120.0° | 119.6° |
| C32 | N33 | C34 | 117.8° | 121.7° |
| N33 | C32 | H34 | 120.0° | 119.6° |
| C31 | C30 | C29 | 123.8° | 118.4° |
| C31 | C30 | H32 | 118.1° | 120.8° |
| C30 | C31 | H33 | 120.7° | 120.4° |
| C08 | S07 | C06 | 107.2° | 103.0° |
| S07 | C08 | H11 | 109.1° | 109.4° |
| S07 | C08 | H12 | 109.1° | 109.5° |
| N33 | C34 | C29 | 125.7° | 120.8° |
| N33 | C34 | H35 | 117.2° | 119.5° |
| C30 | C29 | C34 | 114.1° | 119.2° |
| C30 | C29 | C28 | 121.2° | 120.4° |
| C29 | C30 | H32 | 118.1° | 120.8° |
| S07 | C06 | C05 | 104.7° | 109.4° |
| S07 | C06 | H9 | 110.7° | 109.5° |
| S07 | C06 | H10 | 110.7° | 109.4° |
| C34 | C29 | C28 | 124.6° | 120.4° |
| C29 | C34 | H35 | 117.2° | 119.7° |
| C29 | C28 | N27 | 106.6° | 109.5° |
| C29 | C28 | H30 | 110.2° | 109.5° |
| C29 | C28 | H31 | 110.1° | 109.5° |
| C06 | C05 | N04 | 112.7° | 109.5° |
| C06 | C05 | C25 | 104.6° | 109.4° |
| C06 | C05 | H8 | 108.3° | 109.4° |
| C05 | C06 | H9 | 110.6° | 109.5° |
| C05 | C06 | H10 | 110.7° | 109.5° |
| N04 | C05 | C25 | 114.7° | 109.5° |
| C05 | N04 | C02 | 112.0° | 111.0° |
| N04 | C05 | H8 | 109.1° | 109.5° |
| C05 | N04 | H36 | 108.8° | 111.0° |
| C05 | C25 | N27 | 120.4° | 120.0° |
| C05 | C25 | O26 | 119.9° | 120.0° |
| C25 | C05 | H8 | 107.2° | 109.4° |
| C28 | N27 | C25 | 122.2° | 120.0° |
| N27 | C28 | H30 | 110.2° | 109.4° |
| N27 | C28 | H31 | 110.2° | 109.5° |
| C28 | N27 | H39 | 118.9° | 120.0° |
| N27 | C25 | O26 | 119.7° | 120.0° |
| C25 | N27 | H39 | 118.9° | 120.0° |
| N04 | C02 | C01 | 110.3° | 109.5° |
| N04 | C02 | C03 | 104.7° | 109.5° |
| N04 | C02 | H4 | 111.6° | 109.5° |
| C02 | N04 | H36 | 108.9° | 111.0° |
| C01 | C02 | C03 | 109.0° | 109.5° |
| C02 | C01 | H1 | 109.5° | 109.4° |
| C02 | C01 | H2 | 109.5° | 109.5° |
| C02 | C01 | H3 | 109.4° | 109.4° |
| C01 | C02 | H4 | 110.4° | 109.4° |
| C03 | C02 | H4 | 110.8° | 109.5° |
| C02 | C03 | H5 | 109.5° | 109.5° |
| C02 | C03 | H6 | 109.5° | 109.5° |
| C02 | C03 | H7 | 109.5° | 109.5° |
| H1 | C01 | H2 | 109.4° | 109.5° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.5° |
| H5 | C03 | H6 | 109.5° | 109.4° |
| H5 | C03 | H7 | 109.5° | 109.4° |
| H6 | C03 | H7 | 109.4° | 109.5° |
| H9 | C06 | H10 | 109.5° | 109.5° |
| H11 | C08 | H12 | 109.5° | 109.5° |
| H14 | C10 | H15 | 109.5° | 109.5° |
| H21 | C22 | H22 | 109.5° | 109.5° |
| H21 | C22 | H23 | 109.5° | 109.5° |
| H22 | C22 | H23 | 109.4° | 109.5° |
| H24 | C23 | H25 | 109.5° | 109.5° |
| H24 | C23 | H26 | 109.5° | 109.5° |
| H25 | C23 | H26 | 109.5° | 109.5° |
| H27 | C24 | H28 | 109.4° | 109.5° |
| H27 | C24 | H29 | 109.5° | 109.4° |
| H28 | C24 | H29 | 109.5° | 109.4° |
| H30 | C28 | H31 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | C21 | C23 | C22 | 117.9° | 120.0° |
| C24 | C21 | C23 | O20 | 123.0° | 119.9° |
| C24 | C21 | C22 | O20 | 117.4° | 120.0° |
| C24 | C21 | O20 | C18 | 75.7° | 180.0° |
| C24 | C21 | C22 | H21 | 180.0° | 60.0° |
| C24 | C21 | C22 | H22 | 60.0° | 60.0° |
| C24 | C21 | C22 | H23 | 60.0° | 180.0° |
| C24 | C21 | C23 | H24 | 180.0° | 60.1° |
| C24 | C21 | C23 | H25 | 60.0° | 60.0° |
| C24 | C21 | C23 | H26 | 60.0° | 180.0° |
| C21 | C24 | H27 | H28 | 120.0° | 120.1° |
| C21 | C24 | H27 | H29 | 120.0° | 120.0° |
| C21 | C24 | H28 | H29 | 120.0° | 120.0° |
| O19 | C18 | O20 | C21 | 35.1° | 0.1° |
| O19 | C18 | O20 | N17 | 151.4° | 179.9° |
| O19 | C18 | N17 | C09 | 96.8° | 0.0° |
| O19 | C18 | N17 | H38 | 83.2° | 180.0° |
| C13 | C14 | C15 | H18 | 180.0° | 180.0° |
| C14 | C13 | C12 | H17 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 0.3° | 0.3° |
| C14 | C13 | C12 | C11 | 0.7° | 0.1° |
| C14 | C13 | C12 | H16 | 179.3° | 180.0° |
| C13 | C14 | C15 | H19 | 179.7° | 180.0° |
| C15 | C14 | C13 | C12 | 0.4° | 0.0° |
| C14 | C15 | C16 | H19 | 180.0° | 179.7° |
| C14 | C15 | C16 | C11 | 0.8° | 0.6° |
| C15 | C14 | C13 | H17 | 179.5° | 180.0° |
| C14 | C15 | C16 | H20 | 179.2° | 180.0° |
| C23 | C21 | C22 | O20 | 122.6° | 120.0° |
| C23 | C21 | O20 | C18 | 48.9° | 60.1° |
| C23 | C21 | C22 | H21 | 60.0° | 180.0° |
| C23 | C21 | C22 | H22 | 180.0° | 59.9° |
| C23 | C21 | C22 | H23 | 60.0° | 60.0° |
| C21 | C23 | H24 | H25 | 120.0° | 120.0° |
| C21 | C23 | H24 | H26 | 120.0° | 119.9° |
| C21 | C23 | H25 | H26 | 120.0° | 120.0° |
| C23 | C21 | C24 | H27 | 180.0° | 180.0° |
| C23 | C21 | C24 | H28 | 60.0° | 59.9° |
| C23 | C21 | C24 | H29 | 60.0° | 60.0° |
| C13 | C12 | C11 | H16 | 180.0° | 179.9° |
| C13 | C12 | C11 | C16 | 0.2° | 0.4° |
| C13 | C12 | C11 | C10 | 180.0° | 179.9° |
| C12 | C13 | C14 | H18 | 179.6° | 180.0° |
| C22 | C21 | O20 | C18 | 167.2° | 60.0° |
| C21 | C22 | H21 | H22 | 120.0° | 120.0° |
| C21 | C22 | H21 | H23 | 120.0° | 120.0° |
| C21 | C22 | H22 | H23 | 120.0° | 120.0° |
| C22 | C21 | C23 | H24 | 62.1° | 59.9° |
| C22 | C21 | C23 | H25 | 57.9° | 180.0° |
| C22 | C21 | C23 | H26 | 177.8° | 60.0° |
| C22 | C21 | C24 | H27 | 63.1° | 60.0° |
| C22 | C21 | C24 | H28 | 177.0° | 180.0° |
| C22 | C21 | C24 | H29 | 57.0° | 60.0° |
| C21 | O20 | C18 | N17 | 116.3° | 180.0° |
| O20 | C21 | C22 | H21 | 62.7° | 60.0° |
| O20 | C21 | C22 | H22 | 57.4° | 180.0° |
| O20 | C21 | C22 | H23 | 177.3° | 60.0° |
| O20 | C21 | C23 | H24 | 57.0° | 180.0° |
| O20 | C21 | C23 | H25 | 177.0° | 60.0° |
| O20 | C21 | C23 | H26 | 63.0° | 60.0° |
| O20 | C21 | C24 | H27 | 54.1° | 60.0° |
| O20 | C21 | C24 | H28 | 65.9° | 60.0° |
| O20 | C21 | C24 | H29 | 174.1° | 180.0° |
| O20 | C18 | N17 | C09 | 112.0° | 180.0° |
| O20 | C18 | N17 | H38 | 68.0° | 0.0° |
| C18 | N17 | C09 | H38 | 180.0° | 180.0° |
| C18 | N17 | C09 | C10 | 84.1° | 85.0° |
| C18 | N17 | C09 | C08 | 48.1° | 155.0° |
| C18 | N17 | C09 | H13 | 160.9° | 35.0° |
| C15 | C16 | C11 | C12 | 0.5° | 0.7° |
| C15 | C16 | C11 | H20 | 180.0° | 179.4° |
| C15 | C16 | C11 | C10 | 179.2° | 179.7° |
| C16 | C15 | C14 | H18 | 179.7° | 179.7° |
| C12 | C11 | C16 | C10 | 179.7° | 179.7° |
| C12 | C11 | C10 | C09 | 169.5° | 90.0° |
| C12 | C11 | C10 | H14 | 69.3° | 30.0° |
| C12 | C11 | C10 | H15 | 48.2° | 150.0° |
| C11 | C12 | C13 | H17 | 179.2° | 179.9° |
| C12 | C11 | C16 | H20 | 179.5° | 180.0° |
| C16 | C11 | C10 | C09 | 10.2° | 90.3° |
| C16 | C11 | C10 | H14 | 111.0° | 149.7° |
| C16 | C11 | C10 | H15 | 131.5° | 29.7° |
| C16 | C11 | C12 | H16 | 179.8° | 179.7° |
| C11 | C16 | C15 | H19 | 179.2° | 179.7° |
| C11 | C10 | C09 | N17 | 38.9° | 65.1° |
| C11 | C10 | C09 | H14 | 121.2° | 120.0° |
| C11 | C10 | C09 | H15 | 121.2° | 119.9° |
| C11 | C10 | C09 | C08 | 172.5° | 175.0° |
| C11 | C10 | C09 | H13 | 76.2° | 55.0° |
| C11 | C10 | H14 | H15 | 116.1° | 120.0° |
| C10 | C11 | C12 | H16 | 0.0° | 0.0° |
| C10 | C11 | C16 | H20 | 0.8° | 0.3° |
| N17 | C09 | C10 | C08 | 133.5° | 120.0° |
| N17 | C09 | C10 | H13 | 115.1° | 120.0° |
| N17 | C09 | C08 | H13 | 112.5° | 120.0° |
| N17 | C09 | C08 | S07 | 139.1° | 65.0° |
| N17 | C09 | C08 | H11 | 100.7° | 175.0° |
| N17 | C09 | C08 | H12 | 18.9° | 55.0° |
| N17 | C09 | C10 | H14 | 160.2° | 55.0° |
| N17 | C09 | C10 | H15 | 82.3° | 175.0° |
| C10 | C09 | C08 | H13 | 111.0° | 120.0° |
| C10 | C09 | C08 | S07 | 84.4° | 175.0° |
| C10 | C09 | C08 | H11 | 35.8° | 55.1° |
| C10 | C09 | C08 | H12 | 155.4° | 64.9° |
| C09 | C10 | H14 | H15 | 116.1° | 120.0° |
| C10 | C09 | N17 | H38 | 95.9° | 95.0° |
| C09 | C08 | S07 | H11 | 120.2° | 120.0° |
| C09 | C08 | S07 | H12 | 120.2° | 120.0° |
| C09 | C08 | S07 | C06 | 76.1° | 180.0° |
| C09 | C08 | H11 | H12 | 119.4° | 120.0° |
| C08 | C09 | C10 | H14 | 66.3° | 65.0° |
| C08 | C09 | C10 | H15 | 51.2° | 55.0° |
| C08 | C09 | N17 | H38 | 131.9° | 25.0° |
| C31 | C32 | N33 | H34 | 180.0° | 180.0° |
| C32 | C31 | C30 | H33 | 180.0° | 179.9° |
| C31 | C32 | N33 | C34 | 4.1° | 0.4° |
| C32 | C31 | C30 | C29 | 1.8° | 0.1° |
| C32 | C31 | C30 | H32 | 178.2° | 180.0° |
| N33 | C32 | C31 | C30 | 3.1° | 0.1° |
| C32 | N33 | C34 | C29 | 4.3° | 0.7° |
| N33 | C32 | C31 | H33 | 176.9° | 180.0° |
| C32 | N33 | C34 | H35 | 175.8° | 179.7° |
| C31 | C30 | C29 | H32 | 180.0° | 179.9° |
| C31 | C30 | C29 | C34 | 1.7° | 0.3° |
| C31 | C30 | C29 | C28 | 179.0° | 180.0° |
| C30 | C31 | C32 | H34 | 176.9° | 179.9° |
| C08 | S07 | C06 | C05 | 76.1° | 180.0° |
| C08 | S07 | C06 | H9 | 164.7° | 60.0° |
| C08 | S07 | C06 | H10 | 43.2° | 60.0° |
| S07 | C08 | H11 | H12 | 119.4° | 120.0° |
| S07 | C08 | C09 | H13 | 26.6° | 55.0° |
| N33 | C34 | C29 | C30 | 2.9° | 0.6° |
| N33 | C34 | C29 | H35 | 180.0° | 179.7° |
| N33 | C34 | C29 | C28 | 180.0° | 179.7° |
| C34 | N33 | C32 | H34 | 175.9° | 179.6° |
| C30 | C29 | C34 | C28 | 177.1° | 179.7° |
| C30 | C29 | C28 | N27 | 74.3° | 90.0° |
| C30 | C29 | C28 | H30 | 45.3° | 150.0° |
| C30 | C29 | C28 | H31 | 166.2° | 30.0° |
| C29 | C30 | C31 | H33 | 178.2° | 180.0° |
| C30 | C29 | C34 | H35 | 177.1° | 179.7° |
| S07 | C06 | C05 | H9 | 119.3° | 120.0° |
| S07 | C06 | C05 | H10 | 119.3° | 120.0° |
| S07 | C06 | C05 | N04 | 169.3° | 65.0° |
| S07 | C06 | C05 | C25 | 65.5° | 175.0° |
| S07 | C06 | C05 | H8 | 48.6° | 55.1° |
| S07 | C06 | H9 | H10 | 122.2° | 120.0° |
| C06 | S07 | C08 | H11 | 163.7° | 60.0° |
| C06 | S07 | C08 | H12 | 44.1° | 60.0° |
| C34 | C29 | C28 | N27 | 102.7° | 90.3° |
| C34 | C29 | C28 | H30 | 137.7° | 29.7° |
| C34 | C29 | C28 | H31 | 16.9° | 149.7° |
| C34 | C29 | C30 | H32 | 178.3° | 179.8° |
| C29 | C28 | N27 | H30 | 119.6° | 120.0° |
| C29 | C28 | N27 | H31 | 119.5° | 120.0° |
| C29 | C28 | N27 | C25 | 127.6° | 180.0° |
| C29 | C28 | H30 | H31 | 121.3° | 120.0° |
| C28 | C29 | C30 | H32 | 1.1° | 0.1° |
| C28 | C29 | C34 | H35 | 0.0° | 0.0° |
| C29 | C28 | N27 | H39 | 52.4° | 0.0° |
| C06 | C05 | N04 | C25 | 119.5° | 120.0° |
| C06 | C05 | N04 | H8 | 120.3° | 120.0° |
| C06 | C05 | C25 | H8 | 114.8° | 119.9° |
| C06 | C05 | C25 | N27 | 140.5° | 86.3° |
| C06 | C05 | N04 | C02 | 114.2° | 155.7° |
| C06 | C05 | C25 | O26 | 36.9° | 93.7° |
| C05 | C06 | H9 | H10 | 122.2° | 120.0° |
| C06 | C05 | N04 | H36 | 6.2° | 80.3° |
| N04 | C05 | C25 | H8 | 121.3° | 120.1° |
| N04 | C05 | C25 | N27 | 95.6° | 153.7° |
| C05 | N04 | C02 | H36 | 120.4° | 124.0° |
| N04 | C05 | C25 | O26 | 87.0° | 26.4° |
| C05 | N04 | C02 | C01 | 143.6° | 152.8° |
| C05 | N04 | C02 | C03 | 99.3° | 87.2° |
| C05 | N04 | C02 | H4 | 20.6° | 32.8° |
| N04 | C05 | C06 | H9 | 71.5° | 55.0° |
| N04 | C05 | C06 | H10 | 50.0° | 175.1° |
| C05 | C25 | N27 | C28 | 176.4° | 180.0° |
| C05 | C25 | N27 | O26 | 177.4° | 180.0° |
| C25 | C05 | N04 | C02 | 5.3° | 84.3° |
| C25 | C05 | C06 | H9 | 53.8° | 65.0° |
| C25 | C05 | C06 | H10 | 175.2° | 55.1° |
| C25 | C05 | N04 | H36 | 125.7° | 39.7° |
| C05 | C25 | N27 | H39 | 3.6° | 0.0° |
| C28 | N27 | C25 | H39 | 180.0° | 180.0° |
| C28 | N27 | C25 | O26 | 1.1° | 0.0° |
| N27 | C28 | H30 | H31 | 121.3° | 120.0° |
| N27 | C25 | C05 | H8 | 25.7° | 33.6° |
| C25 | N27 | C28 | H30 | 112.8° | 60.0° |
| C25 | N27 | C28 | H31 | 8.1° | 60.0° |
| N04 | C02 | C01 | C03 | 114.4° | 120.0° |
| N04 | C02 | C01 | H4 | 123.7° | 120.0° |
| N04 | C02 | C03 | H4 | 120.4° | 120.0° |
| N04 | C02 | C01 | H1 | 180.0° | 180.0° |
| N04 | C02 | C01 | H2 | 60.0° | 60.0° |
| N04 | C02 | C01 | H3 | 60.0° | 60.1° |
| N04 | C02 | C03 | H5 | 180.0° | 56.2° |
| N04 | C02 | C03 | H6 | 60.0° | 176.2° |
| N04 | C02 | C03 | H7 | 60.0° | 63.8° |
| C02 | N04 | C05 | H8 | 125.5° | 35.7° |
| O26 | C25 | C05 | H8 | 151.7° | 146.4° |
| O26 | C25 | N27 | H39 | 179.0° | 180.0° |
| C01 | C02 | C03 | H4 | 121.6° | 120.0° |
| C02 | C01 | H1 | H2 | 120.0° | 120.0° |
| C02 | C01 | H1 | H3 | 120.0° | 119.9° |
| C02 | C01 | H2 | H3 | 120.0° | 120.0° |
| C01 | C02 | C03 | H5 | 62.1° | 176.2° |
| C01 | C02 | C03 | H6 | 177.9° | 63.8° |
| C01 | C02 | C03 | H7 | 58.0° | 56.2° |
| C01 | C02 | N04 | H36 | 96.0° | 28.8° |
| C03 | C02 | C01 | H1 | 65.6° | 60.0° |
| C03 | C02 | C01 | H2 | 54.4° | 180.0° |
| C03 | C02 | C01 | H3 | 174.4° | 60.0° |
| C02 | C03 | H5 | H6 | 120.0° | 120.0° |
| C02 | C03 | H5 | H7 | 120.0° | 120.0° |
| C02 | C03 | H6 | H7 | 120.0° | 120.0° |
| C03 | C02 | N04 | H36 | 21.1° | 148.8° |
| H1 | C01 | H2 | H3 | 120.0° | 120.1° |
| H1 | C01 | C02 | H4 | 56.3° | 60.0° |
| H2 | C01 | C02 | H4 | 176.3° | 60.0° |
| H3 | C01 | C02 | H4 | 63.8° | 180.0° |
| H4 | C02 | C03 | H5 | 59.6° | 63.8° |
| H4 | C02 | C03 | H6 | 60.5° | 56.2° |
| H4 | C02 | C03 | H7 | 179.6° | 176.2° |
| H4 | C02 | N04 | H36 | 141.0° | 91.2° |
| H5 | C03 | H6 | H7 | 120.0° | 119.9° |
| H8 | C05 | C06 | H9 | 167.8° | 175.1° |
| H8 | C05 | C06 | H10 | 70.7° | 64.9° |
| H8 | C05 | N04 | H36 | 114.1° | 159.7° |
| H11 | C08 | C09 | H13 | 146.8° | 64.9° |
| H12 | C08 | C09 | H13 | 93.6° | 175.1° |
| H13 | C09 | C10 | H14 | 45.0° | 175.0° |
| H13 | C09 | C10 | H15 | 162.6° | 65.0° |
| H13 | C09 | N17 | H38 | 19.1° | 145.0° |
| H16 | C12 | C13 | H17 | 0.8° | 0.0° |
| H17 | C13 | C14 | H18 | 0.4° | 0.0° |
| H18 | C14 | C15 | H19 | 0.3° | 0.0° |
| H19 | C15 | C16 | H20 | 0.8° | 0.3° |
| H21 | C22 | H22 | H23 | 120.0° | 120.0° |
| H24 | C23 | H25 | H26 | 120.0° | 120.0° |
| H27 | C24 | H28 | H29 | 120.0° | 119.9° |
| H30 | C28 | N27 | H39 | 67.2° | 120.0° |
| H31 | C28 | N27 | H39 | 171.9° | 120.0° |
| H32 | C30 | C31 | H33 | 1.8° | 0.1° |
| H33 | C31 | C32 | H34 | 3.1° | 0.0° |
