9A0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O04 | S03 | doub | 1.42Å | 1.42Å | |
| S03 | O05 | doub | 1.42Å | 1.43Å | |
| S03 | C02 | sing | 1.81Å | 1.76Å | |
| S03 | C06 | sing | 1.76Å | 1.80Å | |
| C33 | C06 | doub | 1.38Å | 1.40Å | Aromatic |
| C33 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
| C30 | C31 | doub | 1.38Å | 1.37Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.37Å | Aromatic |
| C31 | C26 | sing | 1.39Å | 1.38Å | Aromatic |
| C22 | C20 | sing | 1.53Å | 1.53Å | |
| C01 | C02 | sing | 1.53Å | 1.50Å | |
| C29 | C28 | doub | 1.38Å | 1.39Å | Aromatic |
| C06 | C07 | sing | 1.38Å | 1.40Å | Aromatic |
| C32 | C09 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | N25 | sing | 1.40Å | 1.42Å | |
| C26 | C27 | doub | 1.39Å | 1.39Å | Aromatic |
| N25 | C23 | sing | 1.35Å | 1.44Å | |
| C18 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.37Å | Aromatic |
| C28 | C27 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C14 | sing | 1.39Å | 1.41Å | Aromatic |
| C20 | C23 | sing | 1.51Å | 1.53Å | |
| C20 | C17 | sing | 1.51Å | 1.54Å | |
| C20 | C21 | sing | 1.53Å | 1.54Å | |
| C23 | O24 | doub | 1.21Å | 1.21Å | |
| C17 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C07 | C08 | doub | 1.38Å | 1.36Å | Aromatic |
| C09 | C08 | sing | 1.38Å | 1.41Å | Aromatic |
| C09 | C10 | sing | 1.51Å | 1.49Å | |
| C14 | N13 | sing | 1.40Å | 1.44Å | |
| C14 | C15 | doub | 1.39Å | 1.35Å | Aromatic |
| N13 | C11 | sing | 1.35Å | 1.43Å | |
| C16 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.51Å | 1.50Å | |
| C11 | O12 | doub | 1.21Å | 1.22Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C15 | H3 | sing | 1.08Å | 1.08Å | |
| N25 | H4 | sing | 0.97Å | 1.00Å | |
| C31 | H5 | sing | 1.08Å | 1.08Å | |
| C30 | H6 | sing | 1.08Å | 1.08Å | |
| C29 | H7 | sing | 1.08Å | 1.08Å | |
| C28 | H8 | sing | 1.08Å | 1.08Å | |
| C27 | H9 | sing | 1.08Å | 1.08Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C18 | H17 | sing | 1.08Å | 1.08Å | |
| C19 | H18 | sing | 1.08Å | 1.08Å | |
| N13 | H19 | sing | 0.97Å | 1.00Å | |
| C08 | H20 | sing | 1.08Å | 1.08Å | |
| C07 | H21 | sing | 1.08Å | 1.08Å | |
| C32 | H22 | sing | 1.08Å | 1.08Å | |
| C33 | H23 | sing | 1.08Å | 1.08Å | |
| C02 | H24 | sing | 1.09Å | 1.10Å | |
| C02 | H25 | sing | 1.09Å | 1.10Å | |
| C01 | H26 | sing | 1.09Å | 1.10Å | |
| C01 | H27 | sing | 1.09Å | 1.10Å | |
| C01 | H28 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O04 | S03 | O05 | 105.9° | 121.0° |
| O04 | S03 | C02 | 113.4° | 110.5° |
| O04 | S03 | C06 | 112.9° | 104.3° |
| O05 | S03 | C02 | 102.2° | 110.5° |
| O05 | S03 | C06 | 109.9° | 104.3° |
| C02 | S03 | C06 | 111.7° | 104.4° |
| S03 | C02 | C01 | 110.8° | 109.5° |
| S03 | C02 | H24 | 109.2° | 109.5° |
| S03 | C02 | H25 | 109.1° | 109.5° |
| S03 | C06 | C33 | 123.2° | 120.0° |
| S03 | C06 | C07 | 117.9° | 120.0° |
| C06 | C33 | C32 | 121.5° | 120.0° |
| C33 | C06 | C07 | 118.8° | 120.0° |
| C06 | C33 | H23 | 119.3° | 119.9° |
| C33 | C32 | C09 | 117.6° | 120.0° |
| C33 | C32 | H22 | 121.2° | 120.0° |
| C32 | C33 | H23 | 119.2° | 120.0° |
| C31 | C30 | C29 | 120.7° | 120.1° |
| C30 | C31 | C26 | 120.5° | 119.9° |
| C30 | C31 | H5 | 119.7° | 120.0° |
| C31 | C30 | H6 | 119.6° | 119.9° |
| C30 | C29 | C28 | 120.0° | 120.2° |
| C29 | C30 | H6 | 119.6° | 120.0° |
| C30 | C29 | H7 | 120.0° | 119.9° |
| C31 | C26 | N25 | 117.4° | 120.1° |
| C31 | C26 | C27 | 119.1° | 119.8° |
| C26 | C31 | H5 | 119.7° | 120.0° |
| C22 | C20 | C23 | 105.5° | 109.5° |
| C22 | C20 | C17 | 114.0° | 109.4° |
| C22 | C20 | C21 | 111.4° | 109.5° |
| C20 | C22 | H13 | 109.5° | 109.5° |
| C20 | C22 | H14 | 109.4° | 109.5° |
| C20 | C22 | H15 | 109.5° | 109.4° |
| C01 | C02 | H24 | 109.1° | 109.5° |
| C01 | C02 | H25 | 109.1° | 109.5° |
| C02 | C01 | H26 | 109.5° | 109.5° |
| C02 | C01 | H27 | 109.5° | 109.4° |
| C02 | C01 | H28 | 109.5° | 109.4° |
| C29 | C28 | C27 | 119.2° | 120.1° |
| C28 | C29 | H7 | 120.0° | 119.9° |
| C29 | C28 | H8 | 120.4° | 119.9° |
| C06 | C07 | C08 | 121.7° | 120.0° |
| C06 | C07 | H21 | 119.2° | 120.0° |
| C32 | C09 | C08 | 122.0° | 120.0° |
| C32 | C09 | C10 | 121.0° | 120.0° |
| C09 | C32 | H22 | 121.2° | 120.0° |
| N25 | C26 | C27 | 123.4° | 120.1° |
| C26 | N25 | C23 | 123.5° | 120.0° |
| C26 | N25 | H4 | 118.2° | 120.0° |
| C26 | C27 | C28 | 120.4° | 120.0° |
| C26 | C27 | H9 | 119.8° | 120.0° |
| N25 | C23 | C20 | 117.8° | 120.0° |
| N25 | C23 | O24 | 122.4° | 120.0° |
| C23 | N25 | H4 | 118.2° | 120.0° |
| C19 | C18 | C17 | 119.0° | 120.1° |
| C18 | C19 | C14 | 123.7° | 119.9° |
| C19 | C18 | H17 | 120.5° | 119.9° |
| C18 | C19 | H18 | 118.1° | 120.1° |
| C18 | C17 | C20 | 124.0° | 119.9° |
| C18 | C17 | C16 | 116.4° | 120.1° |
| C17 | C18 | H17 | 120.5° | 120.0° |
| C27 | C28 | H8 | 120.4° | 120.0° |
| C28 | C27 | H9 | 119.8° | 120.0° |
| C19 | C14 | N13 | 116.1° | 120.1° |
| C19 | C14 | C15 | 117.6° | 119.8° |
| C14 | C19 | H18 | 118.2° | 120.0° |
| C23 | C20 | C17 | 109.9° | 109.5° |
| C23 | C20 | C21 | 110.2° | 109.5° |
| C20 | C23 | O24 | 119.9° | 120.1° |
| C17 | C20 | C21 | 106.0° | 109.5° |
| C20 | C17 | C16 | 119.6° | 120.0° |
| C20 | C21 | H10 | 109.5° | 109.5° |
| C20 | C21 | H11 | 109.5° | 109.5° |
| C20 | C21 | H12 | 109.5° | 109.5° |
| C17 | C16 | C15 | 125.1° | 120.1° |
| C17 | C16 | H16 | 117.4° | 119.9° |
| C07 | C08 | C09 | 118.4° | 120.0° |
| C07 | C08 | H20 | 120.8° | 120.0° |
| C08 | C07 | H21 | 119.1° | 120.0° |
| C08 | C09 | C10 | 117.0° | 120.0° |
| C09 | C08 | H20 | 120.8° | 120.0° |
| C09 | C10 | C11 | 106.0° | 109.5° |
| C09 | C10 | H1 | 110.4° | 109.5° |
| C09 | C10 | H2 | 110.3° | 109.5° |
| N13 | C14 | C15 | 126.3° | 120.1° |
| C14 | N13 | C11 | 125.9° | 120.0° |
| C14 | N13 | H19 | 117.1° | 120.0° |
| C14 | C15 | C16 | 118.1° | 120.0° |
| C14 | C15 | H3 | 120.9° | 120.0° |
| N13 | C11 | C10 | 116.2° | 120.0° |
| N13 | C11 | O12 | 123.5° | 120.0° |
| C11 | N13 | H19 | 117.0° | 120.0° |
| C16 | C15 | H3 | 120.9° | 120.0° |
| C15 | C16 | H16 | 117.5° | 120.0° |
| C10 | C11 | O12 | 120.3° | 120.0° |
| C11 | C10 | H1 | 110.3° | 109.5° |
| C11 | C10 | H2 | 110.3° | 109.4° |
| H1 | C10 | H2 | 109.5° | 109.4° |
| H10 | C21 | H11 | 109.5° | 109.5° |
| H10 | C21 | H12 | 109.5° | 109.5° |
| H11 | C21 | H12 | 109.5° | 109.5° |
| H13 | C22 | H14 | 109.5° | 109.5° |
| H13 | C22 | H15 | 109.5° | 109.5° |
| H14 | C22 | H15 | 109.5° | 109.5° |
| H24 | C02 | H25 | 109.5° | 109.4° |
| H26 | C01 | H27 | 109.5° | 109.5° |
| H26 | C01 | H28 | 109.5° | 109.5° |
| H27 | C01 | H28 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O04 | S03 | O05 | C02 | 119.0° | 131.5° |
| O04 | S03 | O05 | C06 | 122.2° | 116.8° |
| O04 | S03 | C02 | C06 | 128.9° | 111.6° |
| O04 | S03 | C06 | C33 | 16.3° | 153.9° |
| O04 | S03 | C02 | C01 | 76.6° | 68.4° |
| O04 | S03 | C06 | C07 | 168.6° | 25.1° |
| O04 | S03 | C02 | H24 | 163.2° | 171.6° |
| O04 | S03 | C02 | H25 | 43.5° | 51.7° |
| O05 | S03 | C02 | C06 | 117.5° | 111.7° |
| O05 | S03 | C06 | C33 | 134.3° | 26.1° |
| O05 | S03 | C02 | C01 | 169.8° | 68.4° |
| O05 | S03 | C06 | C07 | 50.6° | 153.0° |
| O05 | S03 | C02 | H24 | 49.6° | 51.7° |
| O05 | S03 | C02 | H25 | 70.0° | 171.6° |
| C02 | S03 | C06 | C33 | 112.9° | 90.0° |
| S03 | C02 | C01 | H24 | 120.2° | 120.0° |
| S03 | C02 | C01 | H25 | 120.2° | 120.0° |
| C02 | S03 | C06 | C07 | 62.2° | 91.0° |
| S03 | C02 | H24 | H25 | 119.4° | 120.0° |
| S03 | C02 | C01 | H26 | 180.0° | 60.0° |
| S03 | C02 | C01 | H27 | 60.0° | 60.0° |
| S03 | C02 | C01 | H28 | 60.0° | 180.0° |
| S03 | C06 | C33 | C07 | 175.1° | 179.0° |
| S03 | C06 | C33 | C32 | 175.8° | 180.0° |
| C06 | S03 | C02 | C01 | 52.3° | 180.0° |
| S03 | C06 | C07 | C08 | 176.5° | 179.7° |
| S03 | C06 | C07 | H21 | 3.5° | 0.4° |
| S03 | C06 | C33 | H23 | 4.2° | 0.9° |
| C06 | S03 | C02 | H24 | 67.9° | 60.0° |
| C06 | S03 | C02 | H25 | 172.5° | 60.0° |
| C06 | C33 | C32 | H23 | 180.0° | 179.1° |
| C06 | C33 | C32 | C09 | 0.5° | 0.7° |
| C33 | C06 | C07 | C08 | 1.2° | 0.6° |
| C33 | C06 | C07 | H21 | 178.8° | 179.4° |
| C06 | C33 | C32 | H22 | 179.5° | 179.4° |
| C32 | C33 | C06 | C07 | 0.7° | 1.0° |
| C33 | C32 | C09 | H22 | 180.0° | 180.0° |
| C33 | C32 | C09 | C08 | 1.4° | 0.0° |
| C33 | C32 | C09 | C10 | 179.3° | 179.7° |
| C31 | C30 | C29 | H6 | 180.0° | 180.0° |
| C30 | C31 | C26 | H5 | 180.0° | 180.0° |
| C31 | C30 | C29 | C28 | 0.4° | 0.0° |
| C30 | C31 | C26 | N25 | 179.7° | 180.0° |
| C30 | C31 | C26 | C27 | 0.6° | 0.3° |
| C31 | C30 | C29 | H7 | 179.6° | 180.0° |
| C29 | C30 | C31 | C26 | 0.5° | 0.0° |
| C30 | C29 | C28 | H7 | 180.0° | 180.0° |
| C30 | C29 | C28 | C27 | 0.5° | 0.3° |
| C29 | C30 | C31 | H5 | 179.5° | 180.0° |
| C30 | C29 | C28 | H8 | 179.5° | 180.0° |
| C31 | C26 | N25 | C27 | 179.1° | 179.7° |
| C31 | C26 | N25 | C23 | 140.7° | 145.0° |
| C31 | C26 | C27 | C28 | 0.7° | 0.6° |
| C31 | C26 | N25 | H4 | 39.3° | 35.0° |
| C26 | C31 | C30 | H6 | 179.5° | 180.0° |
| C31 | C26 | C27 | H9 | 179.3° | 179.7° |
| C22 | C20 | C23 | N25 | 66.5° | 55.1° |
| C22 | C20 | C17 | C18 | 7.0° | 174.6° |
| C22 | C20 | C23 | C17 | 123.3° | 120.0° |
| C22 | C20 | C23 | C21 | 120.3° | 120.0° |
| C22 | C20 | C17 | C21 | 122.9° | 120.0° |
| C22 | C20 | C23 | O24 | 112.4° | 124.9° |
| C22 | C20 | C17 | C16 | 173.7° | 5.1° |
| C22 | C20 | C21 | H10 | 180.0° | 60.0° |
| C22 | C20 | C21 | H11 | 60.0° | 60.0° |
| C22 | C20 | C21 | H12 | 60.0° | 180.0° |
| C20 | C22 | H13 | H14 | 120.0° | 120.0° |
| C20 | C22 | H13 | H15 | 120.0° | 119.9° |
| C20 | C22 | H14 | H15 | 120.0° | 119.9° |
| C01 | C02 | H24 | H25 | 119.4° | 120.0° |
| C02 | C01 | H26 | H27 | 120.0° | 119.9° |
| C02 | C01 | H26 | H28 | 120.0° | 120.0° |
| C02 | C01 | H27 | H28 | 120.0° | 120.0° |
| C29 | C28 | C27 | C26 | 0.6° | 0.6° |
| C29 | C28 | C27 | H8 | 180.0° | 179.7° |
| C28 | C29 | C30 | H6 | 179.6° | 179.9° |
| C29 | C28 | C27 | H9 | 179.4° | 179.6° |
| C06 | C07 | C08 | H21 | 180.0° | 179.9° |
| C06 | C07 | C08 | C09 | 0.4° | 0.0° |
| C06 | C07 | C08 | H20 | 179.6° | 179.9° |
| C07 | C06 | C33 | H23 | 179.3° | 180.0° |
| C32 | C09 | C08 | C07 | 1.0° | 0.3° |
| C32 | C09 | C08 | C10 | 179.3° | 179.7° |
| C32 | C09 | C10 | C11 | 75.1° | 90.2° |
| C32 | C09 | C10 | H1 | 44.3° | 149.7° |
| C32 | C09 | C10 | H2 | 165.5° | 29.7° |
| C32 | C09 | C08 | H20 | 179.0° | 179.8° |
| C09 | C32 | C33 | H23 | 179.5° | 179.7° |
| C26 | N25 | C23 | H4 | 180.0° | 180.0° |
| N25 | C26 | C27 | C28 | 179.7° | 179.7° |
| C26 | N25 | C23 | C20 | 179.5° | 174.6° |
| C26 | N25 | C23 | O24 | 1.6° | 5.4° |
| N25 | C26 | C31 | H5 | 0.3° | 0.0° |
| N25 | C26 | C27 | H9 | 0.3° | 0.1° |
| C27 | C26 | N25 | C23 | 40.2° | 34.8° |
| C26 | C27 | C28 | H9 | 180.0° | 179.7° |
| C27 | C26 | N25 | H4 | 139.8° | 145.2° |
| C27 | C26 | C31 | H5 | 179.4° | 179.7° |
| C26 | C27 | C28 | H8 | 179.4° | 179.7° |
| N25 | C23 | C20 | O24 | 178.9° | 180.0° |
| N25 | C23 | C20 | C17 | 56.8° | 175.1° |
| N25 | C23 | C20 | C21 | 173.2° | 64.9° |
| C19 | C18 | C17 | H17 | 180.0° | 179.9° |
| C18 | C19 | C14 | H18 | 180.0° | 179.9° |
| C19 | C18 | C17 | C20 | 178.9° | 180.0° |
| C19 | C18 | C17 | C16 | 0.5° | 0.3° |
| C18 | C19 | C14 | N13 | 179.4° | 180.0° |
| C18 | C19 | C14 | C15 | 0.3° | 0.2° |
| C17 | C18 | C19 | C14 | 0.2° | 0.0° |
| C18 | C17 | C20 | C23 | 125.1° | 65.4° |
| C18 | C17 | C20 | C16 | 179.4° | 179.7° |
| C18 | C17 | C20 | C21 | 115.9° | 54.6° |
| C18 | C17 | C16 | C15 | 0.4° | 0.3° |
| C18 | C17 | C16 | H16 | 179.6° | 179.7° |
| C17 | C18 | C19 | H18 | 179.8° | 180.0° |
| C27 | C28 | C29 | H7 | 179.5° | 179.7° |
| C19 | C14 | N13 | C15 | 179.7° | 179.7° |
| C19 | C14 | N13 | C11 | 172.7° | 145.2° |
| C19 | C14 | C15 | C16 | 0.4° | 0.2° |
| C19 | C14 | C15 | H3 | 179.6° | 179.8° |
| C14 | C19 | C18 | H17 | 179.8° | 180.0° |
| C19 | C14 | N13 | H19 | 7.4° | 34.8° |
| C23 | C20 | C17 | C21 | 119.0° | 120.0° |
| C23 | C20 | C17 | C16 | 55.5° | 114.9° |
| C20 | C23 | N25 | H4 | 0.5° | 5.4° |
| C23 | C20 | C21 | H10 | 63.3° | 60.0° |
| C23 | C20 | C21 | H11 | 56.7° | 180.0° |
| C23 | C20 | C21 | H12 | 176.7° | 60.0° |
| C23 | C20 | C22 | H13 | 180.0° | 60.0° |
| C23 | C20 | C22 | H14 | 60.0° | 180.0° |
| C23 | C20 | C22 | H15 | 60.0° | 60.0° |
| C17 | C20 | C23 | O24 | 124.3° | 4.9° |
| C20 | C17 | C16 | C15 | 179.0° | 180.0° |
| C17 | C20 | C21 | H10 | 55.5° | 180.0° |
| C17 | C20 | C21 | H11 | 175.5° | 60.0° |
| C17 | C20 | C21 | H12 | 64.5° | 60.0° |
| C17 | C20 | C22 | H13 | 59.4° | 60.0° |
| C17 | C20 | C22 | H14 | 179.4° | 60.1° |
| C17 | C20 | C22 | H15 | 60.6° | 180.0° |
| C20 | C17 | C16 | H16 | 1.0° | 0.0° |
| C20 | C17 | C18 | H17 | 1.2° | 0.0° |
| C21 | C20 | C23 | O24 | 7.9° | 115.1° |
| C21 | C20 | C17 | C16 | 63.5° | 125.1° |
| C20 | C21 | H10 | H11 | 120.0° | 120.0° |
| C20 | C21 | H10 | H12 | 120.0° | 120.0° |
| C20 | C21 | H11 | H12 | 120.0° | 120.0° |
| C21 | C20 | C22 | H13 | 60.5° | 180.0° |
| C21 | C20 | C22 | H14 | 59.5° | 60.0° |
| C21 | C20 | C22 | H15 | 179.5° | 60.0° |
| O24 | C23 | N25 | H4 | 178.4° | 174.6° |
| C17 | C16 | C15 | C14 | 0.0° | 0.0° |
| C17 | C16 | C15 | H16 | 180.0° | 180.0° |
| C17 | C16 | C15 | H3 | 180.0° | 180.0° |
| C16 | C17 | C18 | H17 | 179.5° | 179.8° |
| C07 | C08 | C09 | H20 | 180.0° | 179.9° |
| C07 | C08 | C09 | C10 | 179.7° | 180.0° |
| C08 | C09 | C10 | C11 | 104.2° | 90.1° |
| C08 | C09 | C10 | H1 | 136.4° | 30.0° |
| C08 | C09 | C10 | H2 | 15.2° | 150.0° |
| C09 | C08 | C07 | H21 | 179.7° | 179.9° |
| C08 | C09 | C32 | H22 | 178.6° | 180.0° |
| C09 | C10 | C11 | N13 | 97.4° | 180.0° |
| C09 | C10 | C11 | H1 | 119.5° | 120.1° |
| C09 | C10 | C11 | H2 | 119.4° | 120.0° |
| C09 | C10 | C11 | O12 | 82.3° | 0.1° |
| C09 | C10 | H1 | H2 | 121.6° | 120.0° |
| C10 | C09 | C08 | H20 | 0.3° | 0.1° |
| C10 | C09 | C32 | H22 | 0.7° | 0.3° |
| C14 | N13 | C11 | H19 | 180.0° | 180.0° |
| N13 | C14 | C15 | C16 | 179.2° | 180.0° |
| C14 | N13 | C11 | C10 | 179.0° | 175.3° |
| C14 | N13 | C11 | O12 | 0.8° | 4.6° |
| N13 | C14 | C15 | H3 | 0.8° | 0.0° |
| N13 | C14 | C19 | H18 | 0.6° | 0.0° |
| C15 | C14 | N13 | C11 | 7.7° | 35.1° |
| C14 | C15 | C16 | H3 | 180.0° | 180.0° |
| C14 | C15 | C16 | H16 | 179.9° | 180.0° |
| C15 | C14 | C19 | H18 | 179.7° | 179.7° |
| C15 | C14 | N13 | H19 | 172.3° | 144.9° |
| N13 | C11 | C10 | O12 | 179.8° | 179.9° |
| N13 | C11 | C10 | H1 | 22.0° | 60.0° |
| N13 | C11 | C10 | H2 | 143.1° | 60.0° |
| C11 | C10 | H1 | H2 | 121.6° | 120.0° |
| C10 | C11 | N13 | H19 | 1.1° | 4.7° |
| O12 | C11 | C10 | H1 | 158.2° | 120.0° |
| O12 | C11 | C10 | H2 | 37.1° | 120.0° |
| O12 | C11 | N13 | H19 | 179.2° | 175.4° |
| H3 | C15 | C16 | H16 | 0.1° | 0.0° |
| H5 | C31 | C30 | H6 | 0.5° | 0.0° |
| H6 | C30 | C29 | H7 | 0.4° | 0.0° |
| H7 | C29 | C28 | H8 | 0.5° | 0.0° |
| H8 | C28 | C27 | H9 | 0.6° | 0.0° |
| H10 | C21 | H11 | H12 | 120.0° | 120.0° |
| H13 | C22 | H14 | H15 | 120.0° | 120.0° |
| H17 | C18 | C19 | H18 | 0.2° | 0.1° |
| H20 | C08 | C07 | H21 | 0.4° | 0.0° |
| H22 | C32 | C33 | H23 | 0.5° | 0.3° |
| H24 | C02 | C01 | H26 | 59.8° | 180.0° |
| H24 | C02 | C01 | H27 | 179.8° | 60.0° |
| H24 | C02 | C01 | H28 | 60.2° | 60.0° |
| H25 | C02 | C01 | H26 | 59.8° | 60.0° |
| H25 | C02 | C01 | H27 | 60.2° | 180.0° |
| H25 | C02 | C01 | H28 | 179.8° | 60.0° |
| H26 | C01 | H27 | H28 | 120.0° | 120.1° |
