7S4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C34 | N35 | doub | 1.31Å | 1.35Å | Aromatic |
| C34 | C33 | sing | 1.39Å | 1.40Å | Aromatic |
| N35 | C30 | sing | 1.34Å | 1.39Å | Aromatic |
| C33 | C32 | doub | 1.37Å | 1.38Å | Aromatic |
| C30 | C29 | doub | 1.40Å | 1.43Å | Aromatic |
| C30 | C31 | sing | 1.42Å | 1.36Å | Aromatic |
| C29 | C28 | sing | 1.36Å | 1.39Å | Aromatic |
| C32 | C31 | sing | 1.41Å | 1.42Å | Aromatic |
| C31 | C26 | doub | 1.41Å | 1.43Å | Aromatic |
| C28 | C27 | doub | 1.39Å | 1.40Å | Aromatic |
| C26 | C27 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | N25 | sing | 1.39Å | 1.43Å | |
| N22 | C23 | sing | 1.35Å | 1.42Å | |
| N22 | C21 | doub | 1.32Å | 1.44Å | |
| C23 | N24 | trip | 1.14Å | 1.14Å | |
| N25 | C21 | sing | 1.37Å | 1.43Å | |
| C21 | N20 | sing | 1.37Å | 1.33Å | |
| N20 | C05 | sing | 1.46Å | 1.43Å | |
| C03 | C02 | sing | 1.53Å | 1.51Å | |
| C05 | C02 | sing | 1.53Å | 1.53Å | |
| C05 | N06 | sing | 1.47Å | 1.43Å | |
| C04 | C02 | sing | 1.53Å | 1.51Å | |
| C02 | C01 | sing | 1.53Å | 1.52Å | |
| N06 | C07 | sing | 1.35Å | 1.43Å | |
| O08 | C07 | doub | 1.21Å | 1.21Å | |
| C07 | C09 | sing | 1.51Å | 1.52Å | |
| C09 | C10 | sing | 1.51Å | 1.52Å | |
| C10 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C10 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | O18 | sing | 1.36Å | 1.41Å | |
| C12 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| O18 | C19 | sing | 1.43Å | 1.41Å | |
| C14 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C13 | O16 | sing | 1.36Å | 1.41Å | |
| O16 | C17 | sing | 1.43Å | 1.41Å | |
| C15 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C28 | H5 | sing | 1.08Å | 1.08Å | |
| C01 | H6 | sing | 1.09Å | 1.10Å | |
| C01 | H7 | sing | 1.09Å | 1.10Å | |
| C01 | H8 | sing | 1.09Å | 1.10Å | |
| C03 | H9 | sing | 1.09Å | 1.10Å | |
| C03 | H10 | sing | 1.09Å | 1.10Å | |
| C03 | H11 | sing | 1.09Å | 1.10Å | |
| C04 | H12 | sing | 1.09Å | 1.10Å | |
| C04 | H13 | sing | 1.09Å | 1.10Å | |
| C04 | H14 | sing | 1.09Å | 1.10Å | |
| C05 | H15 | sing | 1.09Å | 1.10Å | |
| N06 | H16 | sing | 0.97Å | 1.00Å | |
| C09 | H17 | sing | 1.09Å | 1.10Å | |
| C09 | H18 | sing | 1.09Å | 1.10Å | |
| C11 | H19 | sing | 1.08Å | 1.08Å | |
| C14 | H20 | sing | 1.08Å | 1.08Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| N20 | H24 | sing | 0.97Å | 1.00Å | |
| N25 | H25 | sing | 0.97Å | 1.00Å | |
| C27 | H26 | sing | 1.08Å | 1.08Å | |
| C29 | H27 | sing | 1.08Å | 1.08Å | |
| C32 | H28 | sing | 1.08Å | 1.08Å | |
| C33 | H29 | sing | 1.08Å | 1.08Å | |
| C34 | H30 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N35 | C34 | C33 | 120.3° | 121.7° |
| C34 | N35 | C30 | 120.0° | 121.3° |
| N35 | C34 | H30 | 119.8° | 119.1° |
| C34 | C33 | C32 | 119.8° | 119.9° |
| C34 | C33 | H29 | 120.1° | 120.0° |
| C33 | C34 | H30 | 119.9° | 119.1° |
| N35 | C30 | C29 | 118.3° | 121.0° |
| N35 | C30 | C31 | 121.6° | 119.8° |
| C33 | C32 | C31 | 120.0° | 118.1° |
| C33 | C32 | H28 | 120.0° | 120.9° |
| C32 | C33 | H29 | 120.1° | 120.0° |
| C29 | C30 | C31 | 120.2° | 119.3° |
| C30 | C29 | C28 | 120.1° | 120.0° |
| C30 | C29 | H27 | 120.0° | 120.0° |
| C30 | C31 | C32 | 118.3° | 119.1° |
| C30 | C31 | C26 | 119.7° | 119.6° |
| C29 | C28 | C27 | 119.9° | 121.2° |
| C29 | C28 | H5 | 120.1° | 119.4° |
| C28 | C29 | H27 | 119.9° | 120.0° |
| C32 | C31 | C26 | 122.0° | 121.4° |
| C31 | C32 | H28 | 120.0° | 120.9° |
| C31 | C26 | C27 | 119.9° | 119.4° |
| C31 | C26 | N25 | 121.0° | 120.3° |
| C28 | C27 | C26 | 120.3° | 120.6° |
| C27 | C28 | H5 | 120.1° | 119.4° |
| C28 | C27 | H26 | 119.9° | 119.7° |
| C27 | C26 | N25 | 119.1° | 120.3° |
| C26 | C27 | H26 | 119.9° | 119.7° |
| C26 | N25 | C21 | 120.4° | 120.0° |
| C26 | N25 | H25 | 119.8° | 120.0° |
| C23 | N22 | C21 | 126.9° | 120.0° |
| N22 | C23 | N24 | 179.5° | 180.0° |
| N22 | C21 | N25 | 116.4° | 120.0° |
| N22 | C21 | N20 | 127.9° | 120.0° |
| N25 | C21 | N20 | 115.7° | 120.0° |
| C21 | N25 | H25 | 119.8° | 120.0° |
| C21 | N20 | C05 | 130.5° | 120.0° |
| C21 | N20 | H24 | 114.8° | 120.0° |
| N20 | C05 | C02 | 108.5° | 109.5° |
| N20 | C05 | N06 | 104.0° | 109.5° |
| N20 | C05 | H15 | 109.5° | 109.5° |
| C05 | N20 | H24 | 114.8° | 120.0° |
| C03 | C02 | C05 | 110.3° | 109.5° |
| C03 | C02 | C04 | 109.3° | 109.5° |
| C03 | C02 | C01 | 108.7° | 109.4° |
| C02 | C03 | H9 | 109.5° | 109.5° |
| C02 | C03 | H10 | 109.5° | 109.4° |
| C02 | C03 | H11 | 109.5° | 109.5° |
| C02 | C05 | N06 | 117.0° | 109.5° |
| C05 | C02 | C04 | 109.5° | 109.5° |
| C05 | C02 | C01 | 110.0° | 109.5° |
| C02 | C05 | H15 | 108.2° | 109.4° |
| C05 | N06 | C07 | 121.9° | 120.0° |
| N06 | C05 | H15 | 109.5° | 109.5° |
| C05 | N06 | H16 | 119.0° | 120.0° |
| C04 | C02 | C01 | 108.9° | 109.5° |
| C02 | C04 | H12 | 109.5° | 109.4° |
| C02 | C04 | H13 | 109.4° | 109.5° |
| C02 | C04 | H14 | 109.5° | 109.5° |
| C02 | C01 | H6 | 109.5° | 109.5° |
| C02 | C01 | H7 | 109.5° | 109.5° |
| C02 | C01 | H8 | 109.5° | 109.5° |
| N06 | C07 | O08 | 120.6° | 120.0° |
| N06 | C07 | C09 | 118.9° | 119.9° |
| C07 | N06 | H16 | 119.1° | 120.1° |
| O08 | C07 | C09 | 120.6° | 120.0° |
| C07 | C09 | C10 | 111.9° | 109.4° |
| C07 | C09 | H17 | 108.9° | 109.5° |
| C07 | C09 | H18 | 108.8° | 109.5° |
| C09 | C10 | C11 | 120.0° | 119.9° |
| C09 | C10 | C15 | 120.0° | 119.9° |
| C10 | C09 | H17 | 108.9° | 109.5° |
| C10 | C09 | H18 | 108.9° | 109.5° |
| C11 | C10 | C15 | 120.0° | 120.2° |
| C10 | C11 | C12 | 120.0° | 120.0° |
| C10 | C11 | H19 | 120.0° | 120.1° |
| C10 | C15 | C14 | 119.9° | 120.1° |
| C10 | C15 | H1 | 120.0° | 119.9° |
| C11 | C12 | O18 | 119.4° | 120.1° |
| C11 | C12 | C13 | 120.1° | 119.8° |
| C12 | C11 | H19 | 120.0° | 120.0° |
| C15 | C14 | C13 | 120.1° | 120.0° |
| C14 | C15 | H1 | 120.0° | 119.9° |
| C15 | C14 | H20 | 119.9° | 120.0° |
| O18 | C12 | C13 | 120.5° | 120.1° |
| C12 | O18 | C19 | 114.0° | 117.0° |
| C12 | C13 | C14 | 119.8° | 119.9° |
| C12 | C13 | O16 | 120.6° | 120.0° |
| O18 | C19 | H21 | 109.5° | 109.5° |
| O18 | C19 | H22 | 109.4° | 109.5° |
| O18 | C19 | H23 | 109.5° | 109.5° |
| C14 | C13 | O16 | 119.6° | 120.1° |
| C13 | C14 | H20 | 119.9° | 120.0° |
| C13 | O16 | C17 | 115.5° | 117.0° |
| O16 | C17 | H2 | 109.5° | 109.5° |
| O16 | C17 | H3 | 109.5° | 109.4° |
| O16 | C17 | H4 | 109.5° | 109.5° |
| H2 | C17 | H3 | 109.4° | 109.5° |
| H2 | C17 | H4 | 109.5° | 109.5° |
| H3 | C17 | H4 | 109.4° | 109.5° |
| H6 | C01 | H7 | 109.5° | 109.4° |
| H6 | C01 | H8 | 109.5° | 109.5° |
| H7 | C01 | H8 | 109.5° | 109.5° |
| H9 | C03 | H10 | 109.5° | 109.5° |
| H9 | C03 | H11 | 109.5° | 109.6° |
| H10 | C03 | H11 | 109.5° | 109.4° |
| H12 | C04 | H13 | 109.5° | 109.4° |
| H12 | C04 | H14 | 109.5° | 109.5° |
| H13 | C04 | H14 | 109.5° | 109.5° |
| H17 | C09 | H18 | 109.5° | 109.5° |
| H21 | C19 | H22 | 109.5° | 109.4° |
| H21 | C19 | H23 | 109.5° | 109.4° |
| H22 | C19 | H23 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N35 | C34 | C33 | H30 | 180.0° | 179.9° |
| N35 | C34 | C33 | C32 | 0.1° | 0.1° |
| C34 | N35 | C30 | C29 | 179.9° | 179.6° |
| C34 | N35 | C30 | C31 | 0.1° | 0.1° |
| N35 | C34 | C33 | H29 | 179.9° | 180.0° |
| C33 | C34 | N35 | C30 | 0.2° | 0.1° |
| C34 | C33 | C32 | H29 | 180.0° | 179.9° |
| C34 | C33 | C32 | C31 | 0.0° | 0.1° |
| C34 | C33 | C32 | H28 | 179.9° | 180.0° |
| N35 | C30 | C29 | C31 | 180.0° | 179.5° |
| N35 | C30 | C29 | C28 | 180.0° | 179.7° |
| N35 | C30 | C31 | C32 | 0.0° | 0.1° |
| N35 | C30 | C31 | C26 | 180.0° | 180.0° |
| N35 | C30 | C29 | H27 | 0.0° | 0.2° |
| C30 | N35 | C34 | H30 | 179.8° | 180.0° |
| C33 | C32 | C31 | C30 | 0.1° | 0.0° |
| C33 | C32 | C31 | H28 | 180.0° | 179.9° |
| C33 | C32 | C31 | C26 | 180.0° | 180.0° |
| C32 | C33 | C34 | H30 | 179.9° | 180.0° |
| C30 | C29 | C28 | H27 | 180.0° | 179.5° |
| C29 | C30 | C31 | C32 | 179.9° | 179.5° |
| C29 | C30 | C31 | C26 | 0.0° | 0.5° |
| C30 | C29 | C28 | C27 | 0.0° | 0.6° |
| C30 | C29 | C28 | H5 | 180.0° | 179.5° |
| C31 | C30 | C29 | C28 | 0.1° | 0.8° |
| C30 | C31 | C32 | C26 | 179.9° | 179.9° |
| C30 | C31 | C26 | C27 | 0.1° | 0.0° |
| C30 | C31 | C26 | N25 | 179.8° | 179.7° |
| C31 | C30 | C29 | H27 | 180.0° | 179.7° |
| C30 | C31 | C32 | H28 | 179.9° | 180.0° |
| C29 | C28 | C27 | H5 | 180.0° | 179.9° |
| C29 | C28 | C27 | C26 | 0.0° | 0.0° |
| C29 | C28 | C27 | H26 | 179.9° | 179.9° |
| C32 | C31 | C26 | C27 | 180.0° | 179.9° |
| C32 | C31 | C26 | N25 | 0.2° | 0.2° |
| C31 | C32 | C33 | H29 | 180.0° | 180.0° |
| C31 | C26 | C27 | C28 | 0.1° | 0.3° |
| C31 | C26 | C27 | N25 | 179.7° | 179.7° |
| C31 | C26 | N25 | C21 | 71.6° | 149.4° |
| C31 | C26 | N25 | H25 | 108.4° | 30.6° |
| C31 | C26 | C27 | H26 | 179.9° | 179.8° |
| C26 | C31 | C32 | H28 | 0.1° | 0.1° |
| C28 | C27 | C26 | H26 | 180.0° | 180.0° |
| C28 | C27 | C26 | N25 | 179.9° | 180.0° |
| C27 | C28 | C29 | H27 | 180.0° | 179.9° |
| C27 | C26 | N25 | C21 | 108.1° | 30.3° |
| C26 | C27 | C28 | H5 | 179.9° | 180.0° |
| C27 | C26 | N25 | H25 | 71.8° | 149.7° |
| C26 | N25 | C21 | N22 | 0.8° | 5.7° |
| C26 | N25 | C21 | H25 | 180.0° | 180.0° |
| C26 | N25 | C21 | N20 | 180.0° | 174.3° |
| N25 | C26 | C27 | H26 | 0.1° | 0.1° |
| C23 | N22 | C21 | N25 | 179.5° | 174.4° |
| C23 | N22 | C21 | N20 | 0.4° | 5.7° |
| C21 | N22 | C23 | N24 | 77.0° | 179.4° |
| N22 | C21 | N25 | N20 | 179.2° | 180.0° |
| N22 | C21 | N20 | C05 | 1.6° | 175.8° |
| N22 | C21 | N20 | H24 | 178.4° | 4.2° |
| N22 | C21 | N25 | H25 | 179.2° | 174.3° |
| N25 | C21 | N20 | C05 | 179.3° | 4.1° |
| N25 | C21 | N20 | H24 | 0.7° | 175.9° |
| C21 | N20 | C05 | H24 | 180.0° | 180.0° |
| C21 | N20 | C05 | C02 | 144.8° | 133.4° |
| C21 | N20 | C05 | N06 | 90.0° | 106.6° |
| C21 | N20 | C05 | H15 | 26.9° | 13.5° |
| N20 | C21 | N25 | H25 | 0.0° | 5.7° |
| N20 | C05 | C02 | C03 | 19.6° | 60.0° |
| N20 | C05 | C02 | N06 | 117.1° | 120.0° |
| N20 | C05 | C02 | H15 | 118.7° | 120.0° |
| N20 | C05 | N06 | H15 | 116.9° | 120.0° |
| N20 | C05 | C02 | C04 | 140.0° | 59.9° |
| N20 | C05 | C02 | C01 | 100.3° | 180.0° |
| N20 | C05 | N06 | C07 | 154.5° | 104.6° |
| N20 | C05 | N06 | H16 | 25.5° | 75.4° |
| C03 | C02 | C05 | C04 | 120.3° | 120.0° |
| C03 | C02 | C05 | C01 | 119.9° | 120.0° |
| C03 | C02 | C05 | N06 | 136.8° | 60.0° |
| C03 | C02 | C04 | C01 | 118.6° | 120.0° |
| C03 | C02 | C01 | H6 | 180.0° | 60.0° |
| C03 | C02 | C01 | H7 | 60.0° | 179.9° |
| C03 | C02 | C01 | H8 | 60.0° | 60.0° |
| C02 | C03 | H9 | H10 | 120.0° | 120.0° |
| C02 | C03 | H9 | H11 | 120.0° | 120.0° |
| C02 | C03 | H10 | H11 | 120.0° | 119.9° |
| C03 | C02 | C04 | H12 | 180.0° | 180.0° |
| C03 | C02 | C04 | H13 | 60.0° | 60.0° |
| C03 | C02 | C04 | H14 | 60.0° | 60.0° |
| C03 | C02 | C05 | H15 | 99.1° | 180.0° |
| C02 | C05 | N06 | H15 | 123.5° | 119.9° |
| C05 | C02 | C04 | C01 | 120.4° | 120.1° |
| C02 | C05 | N06 | C07 | 85.9° | 135.4° |
| C05 | C02 | C01 | H6 | 59.1° | 60.0° |
| C05 | C02 | C01 | H7 | 179.1° | 60.0° |
| C05 | C02 | C01 | H8 | 60.9° | 180.0° |
| C05 | C02 | C03 | H9 | 180.0° | 180.0° |
| C05 | C02 | C03 | H10 | 60.0° | 60.0° |
| C05 | C02 | C03 | H11 | 60.0° | 59.9° |
| C05 | C02 | C04 | H12 | 59.0° | 60.0° |
| C05 | C02 | C04 | H13 | 61.0° | 59.9° |
| C05 | C02 | C04 | H14 | 179.1° | 180.0° |
| C02 | C05 | N06 | H16 | 94.1° | 44.7° |
| C02 | C05 | N20 | H24 | 35.2° | 46.6° |
| N06 | C05 | C02 | C04 | 102.9° | 180.0° |
| N06 | C05 | C02 | C01 | 16.8° | 60.0° |
| C05 | N06 | C07 | H16 | 180.0° | 180.0° |
| C05 | N06 | C07 | O08 | 0.1° | 6.4° |
| C05 | N06 | C07 | C09 | 180.0° | 173.5° |
| N06 | C05 | N20 | H24 | 90.0° | 73.4° |
| C04 | C02 | C01 | H6 | 61.0° | 180.0° |
| C04 | C02 | C01 | H7 | 59.0° | 60.1° |
| C04 | C02 | C01 | H8 | 179.0° | 60.0° |
| C04 | C02 | C03 | H9 | 59.5° | 60.0° |
| C04 | C02 | C03 | H10 | 60.5° | 60.0° |
| C04 | C02 | C03 | H11 | 179.5° | 179.9° |
| C02 | C04 | H12 | H13 | 120.0° | 120.0° |
| C02 | C04 | H12 | H14 | 120.0° | 120.0° |
| C02 | C04 | H13 | H14 | 120.0° | 120.0° |
| C04 | C02 | C05 | H15 | 21.3° | 60.0° |
| C02 | C01 | H6 | H7 | 120.0° | 119.9° |
| C02 | C01 | H6 | H8 | 120.0° | 120.0° |
| C02 | C01 | H7 | H8 | 120.0° | 120.1° |
| C01 | C02 | C03 | H9 | 59.3° | 60.0° |
| C01 | C02 | C03 | H10 | 179.3° | 180.0° |
| C01 | C02 | C03 | H11 | 60.7° | 60.1° |
| C01 | C02 | C04 | H12 | 61.4° | 60.0° |
| C01 | C02 | C04 | H13 | 178.6° | 180.0° |
| C01 | C02 | C04 | H14 | 58.6° | 59.9° |
| C01 | C02 | C05 | H15 | 141.0° | 60.0° |
| N06 | C07 | O08 | C09 | 179.9° | 180.0° |
| N06 | C07 | C09 | C10 | 105.9° | 180.0° |
| C07 | N06 | C05 | H15 | 37.6° | 15.4° |
| N06 | C07 | C09 | H17 | 14.5° | 60.0° |
| N06 | C07 | C09 | H18 | 133.8° | 60.0° |
| O08 | C07 | C09 | C10 | 74.0° | 0.0° |
| O08 | C07 | N06 | H16 | 179.9° | 173.6° |
| O08 | C07 | C09 | H17 | 165.6° | 120.0° |
| O08 | C07 | C09 | H18 | 46.4° | 120.0° |
| C07 | C09 | C10 | H17 | 120.4° | 120.0° |
| C07 | C09 | C10 | H18 | 120.3° | 120.0° |
| C07 | C09 | C10 | C11 | 80.0° | 90.0° |
| C07 | C09 | C10 | C15 | 99.9° | 90.3° |
| C09 | C07 | N06 | H16 | 0.0° | 6.4° |
| C07 | C09 | H17 | H18 | 118.9° | 120.0° |
| C09 | C10 | C11 | C15 | 179.8° | 179.7° |
| C09 | C10 | C11 | C12 | 180.0° | 179.7° |
| C09 | C10 | C15 | C14 | 180.0° | 179.7° |
| C09 | C10 | C15 | H1 | 0.0° | 0.3° |
| C10 | C09 | H17 | H18 | 118.9° | 120.0° |
| C09 | C10 | C11 | H19 | 0.0° | 0.3° |
| C10 | C11 | C12 | H19 | 180.0° | 179.9° |
| C11 | C10 | C15 | C14 | 0.2° | 0.1° |
| C10 | C11 | C12 | O18 | 179.9° | 180.0° |
| C10 | C11 | C12 | C13 | 0.2° | 0.0° |
| C11 | C10 | C15 | H1 | 179.8° | 180.0° |
| C11 | C10 | C09 | H17 | 159.6° | 150.0° |
| C11 | C10 | C09 | H18 | 40.4° | 30.0° |
| C15 | C10 | C11 | C12 | 0.2° | 0.0° |
| C10 | C15 | C14 | H1 | 180.0° | 180.0° |
| C10 | C15 | C14 | C13 | 0.2° | 0.1° |
| C15 | C10 | C09 | H17 | 20.5° | 29.7° |
| C15 | C10 | C09 | H18 | 139.8° | 149.7° |
| C15 | C10 | C11 | H19 | 179.8° | 180.0° |
| C10 | C15 | C14 | H20 | 179.8° | 180.0° |
| C11 | C12 | O18 | C13 | 179.8° | 180.0° |
| C11 | C12 | O18 | C19 | 73.9° | 0.0° |
| C11 | C12 | C13 | C14 | 0.3° | 0.0° |
| C11 | C12 | C13 | O16 | 179.8° | 180.0° |
| C15 | C14 | C13 | C12 | 0.3° | 0.0° |
| C15 | C14 | C13 | H20 | 180.0° | 180.0° |
| C15 | C14 | C13 | O16 | 179.8° | 180.0° |
| O18 | C12 | C13 | C14 | 179.9° | 180.0° |
| O18 | C12 | C13 | O16 | 0.4° | 0.0° |
| O18 | C12 | C11 | H19 | 0.1° | 0.1° |
| C12 | O18 | C19 | H21 | 180.0° | 60.0° |
| C12 | O18 | C19 | H22 | 60.0° | 60.0° |
| C12 | O18 | C19 | H23 | 60.0° | 180.0° |
| C13 | C12 | O18 | C19 | 106.3° | 180.0° |
| C12 | C13 | C14 | O16 | 179.5° | 180.0° |
| C12 | C13 | O16 | C17 | 68.9° | 180.0° |
| C13 | C12 | C11 | H19 | 179.8° | 180.0° |
| C12 | C13 | C14 | H20 | 179.7° | 180.0° |
| O18 | C19 | H21 | H22 | 120.0° | 120.0° |
| O18 | C19 | H21 | H23 | 120.0° | 120.0° |
| O18 | C19 | H22 | H23 | 120.0° | 120.1° |
| C14 | C13 | O16 | C17 | 111.6° | 0.0° |
| C13 | C14 | C15 | H1 | 179.8° | 180.0° |
| C13 | O16 | C17 | H2 | 180.0° | 180.0° |
| C13 | O16 | C17 | H3 | 60.0° | 60.0° |
| C13 | O16 | C17 | H4 | 60.0° | 60.0° |
| O16 | C13 | C14 | H20 | 0.2° | 0.0° |
| O16 | C17 | H2 | H3 | 120.0° | 119.9° |
| O16 | C17 | H2 | H4 | 120.0° | 120.0° |
| O16 | C17 | H3 | H4 | 120.0° | 120.0° |
| H1 | C15 | C14 | H20 | 0.2° | 0.0° |
| H2 | C17 | H3 | H4 | 120.0° | 120.1° |
| H5 | C28 | C27 | H26 | 0.1° | 0.0° |
| H5 | C28 | C29 | H27 | 0.0° | 0.0° |
| H6 | C01 | H7 | H8 | 120.0° | 120.0° |
| H9 | C03 | H10 | H11 | 120.0° | 120.1° |
| H12 | C04 | H13 | H14 | 120.0° | 120.0° |
| H15 | C05 | N06 | H16 | 142.4° | 164.6° |
| H15 | C05 | N20 | H24 | 153.1° | 166.5° |
| H21 | C19 | H22 | H23 | 120.0° | 120.0° |
| H28 | C32 | C33 | H29 | 0.0° | 0.1° |
| H29 | C33 | C34 | H30 | 0.1° | 0.1° |
