UFS
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O30 | C15 | doub | 1.22Å | 1.22Å | |
| O27 | C21 | doub | 1.21Å | 1.22Å | |
| C15 | C16 | sing | 1.48Å | 1.55Å | |
| C15 | C14 | sing | 1.48Å | 1.53Å | |
| C17 | C16 | doub | 1.40Å | 1.40Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.41Å | Aromatic |
| C16 | C29 | sing | 1.40Å | 1.41Å | Aromatic |
| C24 | C25 | sing | 1.47Å | 1.43Å | |
| C24 | C23 | sing | 1.53Å | 1.54Å | |
| C18 | C19 | doub | 1.39Å | 1.41Å | Aromatic |
| C31 | C14 | doub | 1.40Å | 1.40Å | Aromatic |
| C31 | C32 | sing | 1.38Å | 1.41Å | Aromatic |
| C21 | C22 | sing | 1.51Å | 1.51Å | |
| C21 | N20 | sing | 1.35Å | 1.50Å | |
| C29 | C28 | doub | 1.38Å | 1.41Å | Aromatic |
| C19 | C28 | sing | 1.39Å | 1.42Å | Aromatic |
| C19 | N20 | sing | 1.39Å | 1.51Å | |
| C22 | C23 | sing | 1.53Å | 1.57Å | |
| C25 | C26 | trip | 1.17Å | 1.19Å | |
| C14 | C13 | sing | 1.40Å | 1.40Å | Aromatic |
| C32 | C11 | doub | 1.39Å | 1.42Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C12 | sing | 1.39Å | 1.41Å | Aromatic |
| C11 | N10 | sing | 1.39Å | 1.46Å | |
| N10 | C09 | sing | 1.35Å | 1.41Å | |
| C09 | O33 | doub | 1.21Å | 1.23Å | |
| C09 | C08 | sing | 1.51Å | 1.54Å | |
| C08 | C07 | sing | 1.53Å | 1.56Å | |
| C07 | C06 | sing | 1.53Å | 1.55Å | |
| C06 | C05 | sing | 1.53Å | 1.56Å | |
| C05 | C04 | sing | 1.53Å | 1.56Å | |
| C04 | C03 | sing | 1.53Å | 1.55Å | |
| C03 | C02 | sing | 1.51Å | 1.55Å | |
| O01 | C02 | doub | 1.21Å | 1.21Å | |
| C02 | N34 | sing | 1.35Å | 1.48Å | |
| N34 | O35 | sing | 1.42Å | 1.56Å | |
| C13 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.08Å | 1.08Å | |
| C22 | H3 | sing | 1.09Å | 1.10Å | |
| C22 | H4 | sing | 1.09Å | 1.10Å | |
| C24 | H5 | sing | 1.09Å | 1.10Å | |
| C24 | H6 | sing | 1.09Å | 1.10Å | |
| C26 | H7 | sing | 1.05Å | 1.06Å | |
| C28 | H8 | sing | 1.08Å | 1.08Å | |
| C03 | 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 | |
| C05 | H13 | sing | 1.09Å | 1.10Å | |
| C05 | H14 | sing | 1.09Å | 1.10Å | |
| C06 | H15 | sing | 1.09Å | 1.10Å | |
| C07 | H16 | sing | 1.09Å | 1.10Å | |
| C08 | H17 | sing | 1.09Å | 1.10Å | |
| C08 | H18 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.08Å | 1.08Å | |
| C18 | H20 | sing | 1.08Å | 1.08Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C29 | H23 | sing | 1.08Å | 1.08Å | |
| C31 | H24 | sing | 1.08Å | 1.08Å | |
| C32 | H25 | sing | 1.08Å | 1.08Å | |
| N10 | H26 | sing | 0.97Å | 1.00Å | |
| N20 | H27 | sing | 0.97Å | 1.00Å | |
| N34 | H28 | sing | 0.97Å | 1.00Å | |
| O35 | H29 | sing | 0.97Å | 0.95Å | |
| C06 | H30 | sing | 1.09Å | 1.10Å | |
| C07 | H31 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O30 | C15 | C16 | 117.6° | 120.0° |
| O30 | C15 | C14 | 118.7° | 120.0° |
| O27 | C21 | C22 | 118.6° | 120.0° |
| O27 | C21 | N20 | 122.4° | 120.0° |
| C16 | C15 | C14 | 123.7° | 120.0° |
| C15 | C16 | C17 | 124.9° | 120.1° |
| C15 | C16 | C29 | 121.0° | 120.1° |
| C15 | C14 | C31 | 121.3° | 120.1° |
| C15 | C14 | C13 | 124.4° | 120.0° |
| C16 | C17 | C18 | 122.5° | 119.9° |
| C17 | C16 | C29 | 114.1° | 119.8° |
| C16 | C17 | H2 | 118.7° | 120.0° |
| C17 | C18 | C19 | 123.3° | 120.1° |
| C18 | C17 | H2 | 118.8° | 120.0° |
| C17 | C18 | H20 | 118.3° | 120.0° |
| C16 | C29 | C28 | 124.2° | 119.9° |
| C16 | C29 | H23 | 117.9° | 120.0° |
| C25 | C24 | C23 | 115.4° | 109.5° |
| C24 | C25 | C26 | 179.9° | 180.0° |
| C25 | C24 | H5 | 108.0° | 109.5° |
| C25 | C24 | H6 | 108.0° | 109.5° |
| C24 | C23 | C22 | 106.8° | 109.5° |
| C23 | C24 | H5 | 108.0° | 109.4° |
| C23 | C24 | H6 | 108.0° | 109.5° |
| C24 | C23 | H21 | 110.2° | 109.4° |
| C24 | C23 | H22 | 110.1° | 109.5° |
| C18 | C19 | C28 | 114.6° | 120.1° |
| C18 | C19 | N20 | 122.4° | 119.9° |
| C19 | C18 | H20 | 118.3° | 119.9° |
| C14 | C31 | C32 | 123.3° | 119.9° |
| C31 | C14 | C13 | 114.2° | 119.9° |
| C14 | C31 | H24 | 118.4° | 120.0° |
| C31 | C32 | C11 | 122.3° | 120.1° |
| C32 | C31 | H24 | 118.4° | 120.1° |
| C31 | C32 | H25 | 118.9° | 119.9° |
| C22 | C21 | N20 | 119.1° | 120.0° |
| C21 | C22 | C23 | 117.6° | 109.5° |
| C21 | C22 | H3 | 107.4° | 109.4° |
| C21 | C22 | H4 | 107.4° | 109.5° |
| C21 | N20 | C19 | 124.6° | 120.0° |
| C21 | N20 | H27 | 117.7° | 120.0° |
| C29 | C28 | C19 | 121.3° | 120.1° |
| C29 | C28 | H8 | 119.3° | 120.0° |
| C28 | C29 | H23 | 117.9° | 120.1° |
| C28 | C19 | N20 | 123.0° | 120.0° |
| C19 | C28 | H8 | 119.3° | 119.9° |
| C19 | N20 | H27 | 117.7° | 120.0° |
| C23 | C22 | H3 | 107.4° | 109.4° |
| C23 | C22 | H4 | 107.4° | 109.5° |
| C22 | C23 | H21 | 110.1° | 109.5° |
| C22 | C23 | H22 | 110.1° | 109.5° |
| C25 | C26 | H7 | 180.0° | 179.9° |
| C14 | C13 | C12 | 123.4° | 119.9° |
| C14 | C13 | H1 | 118.3° | 120.0° |
| C32 | C11 | C12 | 114.0° | 120.2° |
| C32 | C11 | N10 | 121.2° | 120.0° |
| C11 | C32 | H25 | 118.9° | 120.0° |
| C13 | C12 | C11 | 122.8° | 120.1° |
| C12 | C13 | H1 | 118.3° | 120.1° |
| C13 | C12 | H19 | 118.6° | 119.9° |
| C12 | C11 | N10 | 124.8° | 119.9° |
| C11 | C12 | H19 | 118.6° | 120.0° |
| C11 | N10 | C09 | 126.6° | 120.0° |
| C11 | N10 | H26 | 116.7° | 120.0° |
| N10 | C09 | O33 | 119.7° | 120.0° |
| N10 | C09 | C08 | 128.4° | 120.0° |
| C09 | N10 | H26 | 116.7° | 120.0° |
| O33 | C09 | C08 | 112.0° | 120.0° |
| C09 | C08 | C07 | 112.9° | 109.5° |
| C09 | C08 | H17 | 108.6° | 109.5° |
| C09 | C08 | H18 | 108.6° | 109.4° |
| C08 | C07 | C06 | 115.4° | 109.5° |
| C08 | C07 | H16 | 108.0° | 109.5° |
| C07 | C08 | H17 | 108.6° | 109.5° |
| C07 | C08 | H18 | 108.6° | 109.5° |
| C08 | C07 | H31 | 108.0° | 109.4° |
| C07 | C06 | C05 | 126.9° | 109.5° |
| C07 | C06 | H15 | 104.9° | 109.5° |
| C06 | C07 | H16 | 108.0° | 109.5° |
| C07 | C06 | H30 | 104.9° | 109.4° |
| C06 | C07 | H31 | 108.0° | 109.4° |
| C06 | C05 | C04 | 115.2° | 109.5° |
| C06 | C05 | H13 | 108.1° | 109.5° |
| C06 | C05 | H14 | 108.0° | 109.4° |
| C05 | C06 | H15 | 105.0° | 109.5° |
| C05 | C06 | H30 | 105.0° | 109.4° |
| C05 | C04 | C03 | 110.6° | 109.5° |
| C05 | C04 | H11 | 109.2° | 109.5° |
| C05 | C04 | H12 | 109.2° | 109.4° |
| C04 | C05 | H13 | 108.0° | 109.4° |
| C04 | C05 | H14 | 108.0° | 109.4° |
| C04 | C03 | C02 | 117.2° | 109.5° |
| C04 | C03 | H9 | 107.5° | 109.5° |
| C04 | C03 | H10 | 107.5° | 109.5° |
| C03 | C04 | H11 | 109.2° | 109.5° |
| C03 | C04 | H12 | 109.2° | 109.4° |
| C03 | C02 | O01 | 121.1° | 120.0° |
| C03 | C02 | N34 | 119.9° | 120.0° |
| C02 | C03 | H9 | 107.5° | 109.4° |
| C02 | C03 | H10 | 107.5° | 109.4° |
| O01 | C02 | N34 | 119.0° | 120.0° |
| C02 | N34 | O35 | 113.4° | 120.0° |
| C02 | N34 | H28 | 123.3° | 120.1° |
| O35 | N34 | H28 | 123.3° | 119.9° |
| N34 | O35 | H29 | 109.5° | 114.0° |
| H3 | C22 | H4 | 109.4° | 109.5° |
| H5 | C24 | H6 | 109.4° | 109.5° |
| H9 | C03 | H10 | 109.5° | 109.5° |
| H11 | C04 | H12 | 109.5° | 109.5° |
| H13 | C05 | H14 | 109.5° | 109.5° |
| H15 | C06 | H30 | 109.5° | 109.5° |
| H16 | C07 | H31 | 109.5° | 109.5° |
| H17 | C08 | H18 | 109.5° | 109.5° |
| H21 | C23 | H22 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O30 | C15 | C16 | C14 | 179.6° | 179.9° |
| O30 | C15 | C16 | C17 | 35.9° | 19.3° |
| O30 | C15 | C16 | C29 | 145.2° | 160.7° |
| O30 | C15 | C14 | C31 | 32.5° | 153.8° |
| O30 | C15 | C14 | C13 | 148.7° | 26.2° |
| O27 | C21 | C22 | N20 | 179.5° | 179.9° |
| O27 | C21 | N20 | C19 | 0.5° | 5.0° |
| O27 | C21 | C22 | C23 | 26.3° | 0.1° |
| O27 | C21 | C22 | H3 | 94.9° | 120.0° |
| O27 | C21 | C22 | H4 | 147.5° | 119.9° |
| O27 | C21 | N20 | H27 | 179.5° | 174.9° |
| C15 | C16 | C17 | C29 | 178.9° | 180.0° |
| C15 | C16 | C17 | C18 | 179.5° | 180.0° |
| C16 | C15 | C14 | C31 | 147.9° | 26.1° |
| C15 | C16 | C29 | C28 | 179.7° | 180.0° |
| C16 | C15 | C14 | C13 | 30.9° | 153.9° |
| C15 | C16 | C17 | H2 | 0.5° | 0.4° |
| C15 | C16 | C29 | H23 | 0.3° | 0.0° |
| C14 | C15 | C16 | C17 | 143.7° | 160.6° |
| C14 | C15 | C16 | C29 | 35.2° | 19.3° |
| C15 | C14 | C31 | C13 | 178.9° | 180.0° |
| C15 | C14 | C31 | C32 | 179.6° | 180.0° |
| C15 | C14 | C13 | C12 | 179.7° | 180.0° |
| C15 | C14 | C13 | H1 | 0.3° | 0.2° |
| C15 | C14 | C31 | H24 | 0.4° | 0.1° |
| C16 | C17 | C18 | H2 | 180.0° | 179.6° |
| C16 | C17 | C18 | C19 | 0.2° | 0.1° |
| C17 | C16 | C29 | C28 | 0.7° | 0.0° |
| C16 | C17 | C18 | H20 | 179.9° | 180.0° |
| C17 | C16 | C29 | H23 | 179.2° | 180.0° |
| C18 | C17 | C16 | C29 | 0.6° | 0.1° |
| C17 | C18 | C19 | H20 | 180.0° | 179.9° |
| C17 | C18 | C19 | C28 | 0.2° | 0.1° |
| C17 | C18 | C19 | N20 | 180.0° | 180.0° |
| C16 | C29 | C28 | H23 | 180.0° | 180.0° |
| C16 | C29 | C28 | C19 | 0.4° | 0.0° |
| C29 | C16 | C17 | H2 | 179.4° | 179.7° |
| C16 | C29 | C28 | H8 | 179.5° | 180.0° |
| C25 | C24 | C23 | H5 | 120.9° | 120.0° |
| C25 | C24 | C23 | H6 | 120.9° | 120.0° |
| C25 | C24 | C23 | C22 | 162.0° | 180.0° |
| C25 | C24 | H5 | H6 | 117.3° | 120.0° |
| C24 | C25 | C26 | H7 | 98.8° | 133.9° |
| C25 | C24 | C23 | H21 | 78.4° | 60.0° |
| C25 | C24 | C23 | H22 | 42.4° | 59.9° |
| C24 | C23 | C22 | C21 | 142.1° | 180.0° |
| C24 | C23 | C22 | H21 | 119.6° | 120.0° |
| C24 | C23 | C22 | H22 | 119.6° | 120.0° |
| C23 | C24 | C25 | C26 | 99.7° | 97.0° |
| C24 | C23 | C22 | H3 | 21.0° | 60.1° |
| C24 | C23 | C22 | H4 | 96.7° | 60.0° |
| C23 | C24 | H5 | H6 | 117.3° | 120.0° |
| C24 | C23 | H21 | H22 | 121.3° | 119.9° |
| C18 | C19 | N20 | C21 | 9.0° | 33.8° |
| C18 | C19 | C28 | C29 | 0.1° | 0.0° |
| C18 | C19 | C28 | N20 | 179.9° | 179.9° |
| C19 | C18 | C17 | H2 | 179.9° | 179.7° |
| C18 | C19 | C28 | H8 | 180.0° | 179.9° |
| C18 | C19 | N20 | H27 | 171.0° | 146.2° |
| C14 | C31 | C32 | H24 | 180.0° | 180.0° |
| C14 | C31 | C32 | C11 | 0.6° | 0.2° |
| C31 | C14 | C13 | C12 | 0.8° | 0.0° |
| C31 | C14 | C13 | H1 | 179.2° | 179.8° |
| C14 | C31 | C32 | H25 | 179.4° | 180.0° |
| C32 | C31 | C14 | C13 | 0.6° | 0.0° |
| C31 | C32 | C11 | H25 | 180.0° | 179.7° |
| C31 | C32 | C11 | C12 | 0.6° | 0.5° |
| C31 | C32 | C11 | N10 | 179.5° | 180.0° |
| C22 | C21 | N20 | C19 | 180.0° | 174.9° |
| C21 | C22 | C23 | H3 | 121.2° | 119.9° |
| C21 | C22 | C23 | H4 | 121.2° | 120.0° |
| C21 | C22 | H3 | H4 | 116.3° | 120.0° |
| C21 | C22 | C23 | H21 | 22.6° | 60.0° |
| C21 | C22 | C23 | H22 | 98.3° | 60.0° |
| C22 | C21 | N20 | H27 | 0.0° | 5.1° |
| C21 | N20 | C19 | C28 | 171.2° | 146.2° |
| C21 | N20 | C19 | H27 | 180.0° | 179.9° |
| N20 | C21 | C22 | C23 | 154.2° | 180.0° |
| N20 | C21 | C22 | H3 | 84.6° | 60.1° |
| N20 | C21 | C22 | H4 | 33.0° | 60.0° |
| C29 | C28 | C19 | H8 | 180.0° | 179.9° |
| C29 | C28 | C19 | N20 | 179.9° | 180.0° |
| C28 | C19 | C18 | H20 | 179.8° | 180.0° |
| C19 | C28 | C29 | H23 | 179.5° | 180.0° |
| C28 | C19 | N20 | H27 | 8.8° | 33.7° |
| N20 | C19 | C28 | H8 | 0.1° | 0.0° |
| N20 | C19 | C18 | H20 | 0.1° | 0.0° |
| C23 | C22 | H3 | H4 | 116.3° | 120.0° |
| C22 | C23 | C24 | H5 | 41.1° | 60.0° |
| C22 | C23 | C24 | H6 | 77.1° | 60.0° |
| C22 | C23 | H21 | H22 | 121.2° | 120.1° |
| C26 | C25 | C24 | H5 | 21.2° | 143.0° |
| C26 | C25 | C24 | H6 | 139.4° | 23.0° |
| C14 | C13 | C12 | H1 | 180.0° | 179.8° |
| C14 | C13 | C12 | C11 | 0.9° | 0.2° |
| C14 | C13 | C12 | H19 | 179.1° | 179.7° |
| C13 | C14 | C31 | H24 | 179.3° | 179.9° |
| C32 | C11 | C12 | C13 | 0.7° | 0.5° |
| C32 | C11 | C12 | N10 | 178.9° | 179.6° |
| C32 | C11 | N10 | C09 | 149.5° | 36.0° |
| C32 | C11 | C12 | H19 | 179.3° | 179.5° |
| C11 | C32 | C31 | H24 | 179.4° | 179.8° |
| C32 | C11 | N10 | H26 | 30.5° | 144.0° |
| C13 | C12 | C11 | H19 | 180.0° | 179.9° |
| C13 | C12 | C11 | N10 | 179.6° | 180.0° |
| C12 | C11 | N10 | C09 | 31.7° | 144.5° |
| C11 | C12 | C13 | H1 | 179.1° | 180.0° |
| C12 | C11 | C32 | H25 | 179.4° | 179.8° |
| C12 | C11 | N10 | H26 | 148.3° | 35.6° |
| C11 | N10 | C09 | H26 | 180.0° | 180.0° |
| C11 | N10 | C09 | O33 | 0.3° | 4.7° |
| C11 | N10 | C09 | C08 | 178.5° | 175.4° |
| N10 | C11 | C12 | H19 | 0.4° | 0.1° |
| N10 | C11 | C32 | H25 | 0.5° | 0.2° |
| N10 | C09 | O33 | C08 | 179.0° | 179.9° |
| N10 | C09 | C08 | C07 | 76.8° | 180.0° |
| N10 | C09 | C08 | H17 | 162.7° | 59.9° |
| N10 | C09 | C08 | H18 | 43.7° | 60.0° |
| O33 | C09 | C08 | C07 | 102.0° | 0.1° |
| O33 | C09 | C08 | H17 | 18.5° | 120.0° |
| O33 | C09 | C08 | H18 | 137.4° | 120.0° |
| O33 | C09 | N10 | H26 | 179.8° | 175.2° |
| C09 | C08 | C07 | H17 | 120.5° | 120.1° |
| C09 | C08 | C07 | H18 | 120.5° | 119.9° |
| C09 | C08 | C07 | C06 | 19.8° | 180.0° |
| C09 | C08 | C07 | H16 | 140.7° | 60.0° |
| C09 | C08 | H17 | H18 | 118.4° | 119.9° |
| C08 | C09 | N10 | H26 | 1.5° | 4.7° |
| C09 | C08 | C07 | H31 | 101.1° | 60.1° |
| C08 | C07 | C06 | H16 | 120.9° | 120.0° |
| C08 | C07 | C06 | H31 | 120.8° | 119.9° |
| C08 | C07 | C06 | C05 | 178.8° | 180.0° |
| C08 | C07 | C06 | H15 | 58.9° | 60.0° |
| C08 | C07 | H16 | H31 | 117.3° | 120.0° |
| C07 | C08 | H17 | H18 | 118.5° | 120.0° |
| C08 | C07 | C06 | H30 | 56.5° | 60.1° |
| C07 | C06 | C05 | H15 | 122.3° | 120.0° |
| C07 | C06 | C05 | H30 | 122.3° | 119.9° |
| C07 | C06 | C05 | C04 | 137.7° | 180.0° |
| C07 | C06 | C05 | H13 | 16.9° | 60.0° |
| C07 | C06 | C05 | H14 | 101.5° | 60.1° |
| C07 | C06 | H15 | H30 | 112.2° | 120.0° |
| C06 | C07 | H16 | H31 | 117.3° | 120.0° |
| C06 | C07 | C08 | H17 | 100.7° | 60.0° |
| C06 | C07 | C08 | H18 | 140.3° | 60.1° |
| C06 | C05 | C04 | H13 | 120.9° | 120.1° |
| C06 | C05 | C04 | H14 | 120.8° | 119.9° |
| C06 | C05 | C04 | C03 | 170.3° | 180.0° |
| C06 | C05 | C04 | H11 | 50.1° | 60.0° |
| C06 | C05 | C04 | H12 | 69.6° | 60.1° |
| C06 | C05 | H13 | H14 | 117.4° | 120.0° |
| C05 | C06 | H15 | H30 | 112.2° | 120.0° |
| C05 | C06 | C07 | H16 | 57.9° | 60.0° |
| C05 | C06 | C07 | H31 | 60.3° | 60.1° |
| C05 | C04 | C03 | H11 | 120.2° | 120.0° |
| C05 | C04 | C03 | H12 | 120.2° | 119.9° |
| C05 | C04 | C03 | C02 | 160.9° | 180.0° |
| C05 | C04 | C03 | H9 | 39.8° | 60.0° |
| C05 | C04 | C03 | H10 | 78.0° | 60.1° |
| C05 | C04 | H11 | H12 | 119.5° | 120.0° |
| C04 | C05 | H13 | H14 | 117.4° | 120.0° |
| C04 | C05 | C06 | H15 | 99.9° | 60.0° |
| C04 | C05 | C06 | H30 | 15.4° | 60.1° |
| C04 | C03 | C02 | H9 | 121.1° | 120.1° |
| C04 | C03 | C02 | H10 | 121.1° | 120.0° |
| C04 | C03 | C02 | O01 | 62.1° | 0.1° |
| C04 | C03 | C02 | N34 | 117.6° | 180.0° |
| C04 | C03 | H9 | H10 | 116.5° | 120.1° |
| C03 | C04 | H11 | H12 | 119.5° | 120.0° |
| C03 | C04 | C05 | H13 | 68.9° | 59.9° |
| C03 | C04 | C05 | H14 | 49.4° | 60.1° |
| C03 | C02 | O01 | N34 | 179.8° | 180.0° |
| C03 | C02 | N34 | O35 | 180.0° | 180.0° |
| C02 | C03 | H9 | H10 | 116.5° | 119.9° |
| C02 | C03 | C04 | H11 | 78.9° | 60.0° |
| C02 | C03 | C04 | H12 | 40.7° | 60.1° |
| C03 | C02 | N34 | H28 | 0.0° | 0.0° |
| O01 | C02 | N34 | O35 | 0.2° | 0.0° |
| O01 | C02 | C03 | H9 | 176.7° | 120.0° |
| O01 | C02 | C03 | H10 | 58.9° | 120.0° |
| O01 | C02 | N34 | H28 | 179.8° | 179.9° |
| C02 | N34 | O35 | H28 | 180.0° | 179.9° |
| N34 | C02 | C03 | H9 | 3.5° | 60.0° |
| N34 | C02 | C03 | H10 | 121.3° | 60.0° |
| C02 | N34 | O35 | H29 | 0.1° | 180.0° |
| H1 | C13 | C12 | H19 | 0.9° | 0.1° |
| H2 | C17 | C18 | H20 | 0.1° | 0.3° |
| H3 | C22 | C23 | H21 | 98.6° | 180.0° |
| H3 | C22 | C23 | H22 | 140.6° | 60.0° |
| H4 | C22 | C23 | H21 | 143.7° | 60.0° |
| H4 | C22 | C23 | H22 | 22.9° | 180.0° |
| H5 | C24 | C23 | H21 | 160.7° | 180.0° |
| H5 | C24 | C23 | H22 | 78.5° | 60.0° |
| H6 | C24 | C23 | H21 | 42.4° | 60.0° |
| H6 | C24 | C23 | H22 | 163.3° | 179.9° |
| H8 | C28 | C29 | H23 | 0.5° | 0.1° |
| H9 | C03 | C04 | H11 | 160.0° | 180.0° |
| H9 | C03 | C04 | H12 | 80.4° | 59.9° |
| H10 | C03 | C04 | H11 | 42.2° | 60.0° |
| H10 | C03 | C04 | H12 | 161.8° | 180.0° |
| H11 | C04 | C05 | H13 | 170.9° | 179.9° |
| H11 | C04 | C05 | H14 | 70.8° | 59.9° |
| H12 | C04 | C05 | H13 | 51.3° | 60.0° |
| H12 | C04 | C05 | H14 | 169.6° | 180.0° |
| H13 | C05 | C06 | H15 | 139.2° | 180.0° |
| H13 | C05 | C06 | H30 | 105.4° | 59.9° |
| H14 | C05 | C06 | H15 | 20.9° | 60.0° |
| H14 | C05 | C06 | H30 | 136.2° | NaN° |
| H15 | C06 | C07 | H16 | 179.7° | 180.0° |
| H15 | C06 | C07 | H31 | 62.0° | 59.9° |
| H16 | C07 | C08 | H17 | 20.1° | 180.0° |
| H16 | C07 | C08 | H18 | 98.8° | 60.0° |
| H16 | C07 | C06 | H30 | 64.4° | 59.9° |
| H17 | C08 | C07 | H31 | 138.4° | 60.0° |
| H18 | C08 | C07 | H31 | 19.5° | 180.0° |
| H24 | C31 | C32 | H25 | 0.6° | 0.0° |
| H28 | N34 | O35 | H29 | 179.9° | 0.1° |
| H30 | C06 | C07 | H31 | 177.3° | 180.0° |
