O43
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C06 | C05 | sing | 1.53Å | 1.52Å | |
| C06 | C04 | sing | 1.53Å | 1.51Å | |
| C05 | C04 | sing | 1.53Å | 1.51Å | |
| C04 | N03 | sing | 1.47Å | 1.46Å | |
| N03 | C02 | sing | 1.35Å | 1.46Å | |
| O01 | C02 | doub | 1.22Å | 1.21Å | |
| C02 | C07 | sing | 1.48Å | 1.54Å | |
| C07 | C08 | doub | 1.40Å | 1.39Å | Aromatic |
| C07 | C12 | sing | 1.40Å | 1.39Å | Aromatic |
| C08 | C09 | sing | 1.37Å | 1.41Å | Aromatic |
| C12 | C11 | doub | 1.36Å | 1.40Å | Aromatic |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C24 | C23 | sing | 1.53Å | 1.54Å | |
| C09 | C10 | doub | 1.40Å | 1.40Å | Aromatic |
| C25 | C26 | sing | 1.53Å | 1.52Å | |
| C11 | C10 | sing | 1.40Å | 1.40Å | Aromatic |
| C26 | C21 | sing | 1.53Å | 1.53Å | |
| C10 | C13 | sing | 1.47Å | 1.53Å | |
| C23 | C22 | sing | 1.53Å | 1.52Å | |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C21 | N20 | sing | 1.47Å | 1.46Å | |
| C13 | N17 | sing | 1.37Å | 1.36Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.37Å | Aromatic |
| N18 | N17 | sing | 1.40Å | 1.41Å | Aromatic |
| N18 | C19 | doub | 1.31Å | 1.38Å | Aromatic |
| N20 | C19 | sing | 1.39Å | 1.43Å | |
| N17 | C16 | sing | 1.37Å | 1.34Å | Aromatic |
| C14 | N15 | sing | 1.33Å | 1.35Å | Aromatic |
| C19 | C27 | sing | 1.40Å | 1.44Å | Aromatic |
| C16 | N15 | doub | 1.33Å | 1.39Å | Aromatic |
| C16 | C28 | sing | 1.42Å | 1.43Å | Aromatic |
| C27 | C28 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | N29 | sing | 1.39Å | 1.48Å | |
| N29 | C30 | sing | 1.46Å | 1.49Å | |
| C30 | C31 | sing | 1.53Å | 1.55Å | |
| C31 | C36 | sing | 1.53Å | 1.48Å | |
| C31 | C32 | sing | 1.53Å | 1.49Å | |
| C36 | C35 | sing | 1.53Å | 1.52Å | |
| C32 | C33 | sing | 1.53Å | 1.52Å | |
| C35 | O34 | sing | 1.43Å | 1.48Å | |
| C33 | O34 | sing | 1.43Å | 1.47Å | |
| N03 | H1 | sing | 0.97Å | 1.00Å | |
| C04 | H2 | sing | 1.09Å | 1.10Å | |
| C05 | H3 | sing | 1.09Å | 1.10Å | |
| C05 | H4 | sing | 1.09Å | 1.10Å | |
| C06 | H5 | sing | 1.09Å | 1.10Å | |
| C06 | H6 | sing | 1.09Å | 1.10Å | |
| C08 | H7 | sing | 1.08Å | 1.08Å | |
| C09 | H8 | sing | 1.08Å | 1.08Å | |
| C11 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C14 | H11 | sing | 1.08Å | 1.08Å | |
| N20 | H12 | sing | 0.97Å | 1.00Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C26 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.08Å | 1.08Å | |
| N29 | H25 | sing | 0.97Å | 1.00Å | |
| C30 | H26 | sing | 1.09Å | 1.10Å | |
| C30 | H27 | sing | 1.09Å | 1.10Å | |
| C31 | H28 | sing | 1.09Å | 1.10Å | |
| C32 | H29 | sing | 1.09Å | 1.10Å | |
| C32 | H30 | sing | 1.09Å | 1.10Å | |
| C33 | H31 | sing | 1.09Å | 1.10Å | |
| C33 | H32 | sing | 1.09Å | 1.10Å | |
| C35 | H33 | sing | 1.09Å | 1.10Å | |
| C35 | H34 | sing | 1.09Å | 1.10Å | |
| C36 | H35 | sing | 1.09Å | 1.10Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C05 | C06 | C04 | 59.6° | 60.0° |
| C06 | C05 | C04 | 60.1° | 60.0° |
| C06 | C05 | H3 | 120.0° | 117.6° |
| C06 | C05 | H4 | 120.0° | 117.5° |
| C05 | C06 | H5 | 120.1° | 117.6° |
| C05 | C06 | H6 | 120.0° | 117.5° |
| C06 | C04 | C05 | 60.3° | 60.0° |
| C06 | C04 | N03 | 115.4° | 117.5° |
| C06 | C04 | H2 | 117.9° | 117.5° |
| C04 | C06 | H5 | 120.1° | 117.5° |
| C04 | C06 | H6 | 120.0° | 117.5° |
| C05 | C04 | N03 | 112.5° | 117.4° |
| C05 | C04 | H2 | 118.0° | 117.5° |
| C04 | C05 | H3 | 120.0° | 117.5° |
| C04 | C05 | H4 | 120.0° | 117.5° |
| C04 | N03 | C02 | 116.0° | 120.0° |
| C04 | N03 | H1 | 122.0° | 120.1° |
| N03 | C04 | H2 | 119.1° | 115.6° |
| N03 | C02 | O01 | 119.4° | 120.0° |
| N03 | C02 | C07 | 119.4° | 120.0° |
| C02 | N03 | H1 | 122.0° | 120.0° |
| O01 | C02 | C07 | 121.2° | 120.0° |
| C02 | C07 | C08 | 119.0° | 120.0° |
| C02 | C07 | C12 | 119.5° | 120.0° |
| C08 | C07 | C12 | 121.5° | 120.0° |
| C07 | C08 | C09 | 119.9° | 119.9° |
| C07 | C08 | H7 | 120.1° | 120.0° |
| C07 | C12 | C11 | 119.5° | 120.0° |
| C07 | C12 | H10 | 120.3° | 120.0° |
| C08 | C09 | C10 | 117.9° | 120.0° |
| C09 | C08 | H7 | 120.0° | 120.0° |
| C08 | C09 | H8 | 121.1° | 120.0° |
| C12 | C11 | C10 | 118.8° | 120.0° |
| C12 | C11 | H9 | 120.6° | 120.0° |
| C11 | C12 | H10 | 120.3° | 120.0° |
| C25 | C24 | C23 | 116.4° | 109.5° |
| C24 | C25 | C26 | 112.0° | 109.4° |
| C25 | C24 | H18 | 107.7° | 109.5° |
| C25 | C24 | H19 | 107.7° | 109.5° |
| C24 | C25 | H20 | 108.8° | 109.4° |
| C24 | C25 | H21 | 108.8° | 109.5° |
| C24 | C23 | C22 | 113.7° | 109.4° |
| C24 | C23 | H16 | 108.4° | 109.5° |
| C24 | C23 | H17 | 108.4° | 109.5° |
| C23 | C24 | H18 | 107.7° | 109.5° |
| C23 | C24 | H19 | 107.7° | 109.5° |
| C09 | C10 | C11 | 122.5° | 120.0° |
| C09 | C10 | C13 | 119.7° | 120.0° |
| C10 | C09 | H8 | 121.1° | 120.0° |
| C25 | C26 | C21 | 110.2° | 109.5° |
| C26 | C25 | H20 | 108.8° | 109.5° |
| C26 | C25 | H21 | 108.8° | 109.5° |
| C25 | C26 | H22 | 109.3° | 109.4° |
| C25 | C26 | H23 | 109.3° | 109.5° |
| C11 | C10 | C13 | 117.9° | 120.0° |
| C10 | C11 | H9 | 120.6° | 120.0° |
| C26 | C21 | C22 | 110.5° | 109.5° |
| C26 | C21 | N20 | 108.3° | 109.5° |
| C26 | C21 | H13 | 107.2° | 109.5° |
| C21 | C26 | H22 | 109.3° | 109.5° |
| C21 | C26 | H23 | 109.3° | 109.5° |
| C10 | C13 | N17 | 123.1° | 126.7° |
| C10 | C13 | C14 | 127.1° | 126.6° |
| C23 | C22 | C21 | 106.3° | 109.5° |
| C23 | C22 | H14 | 110.3° | 109.5° |
| C23 | C22 | H15 | 110.3° | 109.4° |
| C22 | C23 | H16 | 108.4° | 109.5° |
| C22 | C23 | H17 | 108.4° | 109.5° |
| C22 | C21 | N20 | 115.1° | 109.4° |
| C22 | C21 | H13 | 107.3° | 109.5° |
| C21 | C22 | H14 | 110.3° | 109.5° |
| C21 | C22 | H15 | 110.2° | 109.5° |
| C21 | N20 | C19 | 129.9° | 120.0° |
| C21 | N20 | H12 | 104.1° | 120.1° |
| N20 | C21 | H13 | 108.1° | 109.5° |
| N17 | C13 | C14 | 109.7° | 106.7° |
| C13 | N17 | N18 | 129.2° | 132.6° |
| C13 | N17 | C16 | 106.9° | 107.1° |
| C13 | C14 | N15 | 107.0° | 108.1° |
| C13 | C14 | H11 | 126.5° | 125.9° |
| N17 | N18 | C19 | 118.1° | 120.9° |
| N18 | N17 | C16 | 123.9° | 120.3° |
| N18 | C19 | N20 | 123.4° | 119.7° |
| N18 | C19 | C27 | 119.6° | 120.8° |
| N20 | C19 | C27 | 116.9° | 119.6° |
| C19 | N20 | H12 | 104.1° | 120.0° |
| N17 | C16 | N15 | 108.8° | 108.6° |
| N17 | C16 | C28 | 119.0° | 119.1° |
| C14 | N15 | C16 | 107.5° | 109.5° |
| N15 | C14 | H11 | 126.5° | 126.0° |
| C19 | C27 | C28 | 120.3° | 119.8° |
| C19 | C27 | H24 | 119.9° | 120.1° |
| N15 | C16 | C28 | 132.2° | 132.2° |
| C16 | C28 | C27 | 119.0° | 119.0° |
| C16 | C28 | N29 | 119.8° | 120.5° |
| C27 | C28 | N29 | 121.1° | 120.5° |
| C28 | C27 | H24 | 119.9° | 120.0° |
| C28 | N29 | C30 | 117.4° | 120.0° |
| C28 | N29 | H25 | 107.5° | 120.0° |
| N29 | C30 | C31 | 113.3° | 109.5° |
| C30 | N29 | H25 | 107.5° | 120.0° |
| N29 | C30 | H26 | 108.5° | 109.4° |
| N29 | C30 | H27 | 108.5° | 109.5° |
| C30 | C31 | C36 | 105.5° | 109.6° |
| C30 | C31 | C32 | 107.0° | 109.5° |
| C31 | C30 | H26 | 108.5° | 109.4° |
| C31 | C30 | H27 | 108.5° | 109.4° |
| C30 | C31 | H28 | 108.6° | 109.5° |
| C36 | C31 | C32 | 116.7° | 109.0° |
| C31 | C36 | C35 | 113.7° | 109.2° |
| C36 | C31 | H28 | 109.4° | 109.6° |
| C31 | C36 | H35 | 108.4° | 109.6° |
| C31 | C36 | H36 | 108.4° | 109.5° |
| C31 | C32 | C33 | 116.5° | 109.1° |
| C32 | C31 | H28 | 109.3° | 109.6° |
| C31 | C32 | H29 | 107.7° | 109.5° |
| C31 | C32 | H30 | 107.7° | 109.5° |
| C36 | C35 | O34 | 111.8° | 109.4° |
| C36 | C35 | H33 | 108.8° | 109.5° |
| C36 | C35 | H34 | 108.9° | 109.5° |
| C35 | C36 | H35 | 108.4° | 109.5° |
| C35 | C36 | H36 | 108.4° | 109.6° |
| C32 | C33 | O34 | 111.7° | 109.4° |
| C33 | C32 | H29 | 107.7° | 109.6° |
| C33 | C32 | H30 | 107.7° | 109.5° |
| C32 | C33 | H31 | 108.9° | 109.5° |
| C32 | C33 | H32 | 109.0° | 109.5° |
| C35 | O34 | C33 | 114.3° | 114.1° |
| O34 | C35 | H33 | 108.9° | 109.4° |
| O34 | C35 | H34 | 108.9° | 109.5° |
| O34 | C33 | H31 | 108.9° | 109.5° |
| O34 | C33 | H32 | 108.9° | 109.5° |
| H3 | C05 | H4 | 109.5° | 115.5° |
| H5 | C06 | H6 | 109.5° | 115.5° |
| H14 | C22 | H15 | 109.5° | 109.5° |
| H16 | C23 | H17 | 109.4° | 109.5° |
| H18 | C24 | H19 | 109.5° | 109.4° |
| H20 | C25 | H21 | 109.5° | 109.5° |
| H22 | C26 | H23 | 109.4° | 109.5° |
| H26 | C30 | H27 | 109.5° | 109.5° |
| H29 | C32 | H30 | 109.5° | 109.6° |
| H31 | C33 | H32 | 109.5° | 109.4° |
| H33 | C35 | H34 | 109.5° | 109.5° |
| H35 | C36 | H36 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C05 | C06 | C04 | H5 | 109.4° | 107.6° |
| C05 | C06 | C04 | H6 | 109.4° | 107.5° |
| C06 | C05 | C04 | H3 | 109.5° | 107.6° |
| C06 | C05 | C04 | H4 | 109.5° | 107.5° |
| C05 | C06 | C04 | N03 | 102.5° | 107.4° |
| C05 | C06 | C04 | H2 | 108.1° | 107.5° |
| C06 | C05 | H3 | H4 | 144.7° | 145.7° |
| C05 | C06 | H5 | H6 | 144.9° | 145.7° |
| C06 | C04 | N03 | H2 | 149.1° | 145.8° |
| C06 | C04 | N03 | C02 | 155.9° | 136.3° |
| C06 | C04 | N03 | H1 | 24.1° | 43.6° |
| C04 | C06 | H5 | H6 | 144.9° | 145.6° |
| C05 | C04 | N03 | H2 | 144.3° | 145.6° |
| C05 | C04 | N03 | C02 | 89.3° | 155.1° |
| C05 | C04 | N03 | H1 | 90.7° | 25.0° |
| C04 | C05 | H3 | H4 | 144.7° | 145.6° |
| C04 | N03 | C02 | H1 | 180.0° | 179.9° |
| C04 | N03 | C02 | O01 | 0.6° | 0.1° |
| C04 | N03 | C02 | C07 | 179.9° | 179.7° |
| N03 | C04 | C05 | H3 | 143.1° | 0.0° |
| N03 | C04 | C05 | H4 | 2.1° | 145.0° |
| N03 | C04 | C06 | H5 | 6.9° | 145.0° |
| N03 | C04 | C06 | H6 | 148.2° | 0.1° |
| N03 | C02 | O01 | C07 | 179.5° | 179.8° |
| N03 | C02 | C07 | C08 | 34.1° | 179.7° |
| N03 | C02 | C07 | C12 | 145.0° | 0.6° |
| C02 | N03 | C04 | H2 | 55.0° | 9.5° |
| O01 | C02 | C07 | C08 | 146.4° | 0.0° |
| O01 | C02 | C07 | C12 | 34.5° | 179.7° |
| O01 | C02 | N03 | H1 | 179.4° | 180.0° |
| C02 | C07 | C08 | C12 | 179.1° | 179.7° |
| C02 | C07 | C08 | C09 | 179.5° | 180.0° |
| C02 | C07 | C12 | C11 | 179.7° | 179.7° |
| C07 | C02 | N03 | H1 | 0.1° | 0.2° |
| C02 | C07 | C08 | H7 | 0.5° | 0.0° |
| C02 | C07 | C12 | H10 | 0.3° | 0.0° |
| C07 | C08 | C09 | H7 | 180.0° | 180.0° |
| C08 | C07 | C12 | C11 | 0.6° | 0.6° |
| C07 | C08 | C09 | C10 | 0.3° | 0.0° |
| C07 | C08 | C09 | H8 | 179.7° | 180.0° |
| C08 | C07 | C12 | H10 | 179.4° | 179.7° |
| C12 | C07 | C08 | C09 | 0.4° | 0.3° |
| C07 | C12 | C11 | H10 | 180.0° | 179.7° |
| C07 | C12 | C11 | C10 | 0.7° | 0.6° |
| C12 | C07 | C08 | H7 | 179.6° | 179.7° |
| C07 | C12 | C11 | H9 | 179.3° | 179.7° |
| C08 | C09 | C10 | H8 | 180.0° | 180.0° |
| C08 | C09 | C10 | C11 | 0.4° | 0.0° |
| C08 | C09 | C10 | C13 | 179.9° | 180.0° |
| C12 | C11 | C10 | C09 | 0.6° | 0.3° |
| C12 | C11 | C10 | H9 | 180.0° | 179.7° |
| C12 | C11 | C10 | C13 | 179.8° | 179.7° |
| C25 | C24 | C23 | H18 | 121.0° | 120.1° |
| C25 | C24 | C23 | H19 | 121.0° | 120.0° |
| C24 | C25 | C26 | H20 | 120.4° | 119.9° |
| C24 | C25 | C26 | H21 | 120.4° | 120.0° |
| C24 | C25 | C26 | C21 | 48.6° | 60.1° |
| C25 | C24 | C23 | C22 | 43.4° | 60.0° |
| C25 | C24 | C23 | H16 | 77.2° | 180.0° |
| C25 | C24 | C23 | H17 | 164.1° | 60.0° |
| C25 | C24 | H18 | H19 | 116.8° | 120.0° |
| C24 | C25 | H20 | H21 | 118.8° | 120.0° |
| C24 | C25 | C26 | H22 | 71.5° | 180.0° |
| C24 | C25 | C26 | H23 | 168.7° | 60.0° |
| C23 | C24 | C25 | C26 | 39.2° | 60.0° |
| C24 | C23 | C22 | H16 | 120.7° | 120.0° |
| C24 | C23 | C22 | H17 | 120.6° | 120.0° |
| C24 | C23 | C22 | C21 | 54.7° | 60.0° |
| C24 | C23 | C22 | H14 | 174.2° | 60.0° |
| C24 | C23 | C22 | H15 | 64.8° | 180.0° |
| C24 | C23 | H16 | H17 | 118.0° | 120.0° |
| C23 | C24 | H18 | H19 | 116.9° | 120.0° |
| C23 | C24 | C25 | H20 | 159.6° | 180.0° |
| C23 | C24 | C25 | H21 | 81.1° | 60.0° |
| C09 | C10 | C11 | C13 | 179.7° | 179.9° |
| C09 | C10 | C13 | N17 | 152.2° | 175.0° |
| C09 | C10 | C13 | C14 | 27.2° | 5.3° |
| C10 | C09 | C08 | H7 | 179.7° | 180.0° |
| C09 | C10 | C11 | H9 | 179.4° | 180.0° |
| C25 | C26 | C21 | H22 | 120.1° | 119.9° |
| C25 | C26 | C21 | H23 | 120.1° | 120.0° |
| C25 | C26 | C21 | C22 | 64.8° | 60.1° |
| C25 | C26 | C21 | N20 | 168.2° | 180.0° |
| C25 | C26 | C21 | H13 | 51.8° | 60.0° |
| C26 | C25 | C24 | H18 | 160.2° | 60.0° |
| C26 | C25 | C24 | H19 | 81.8° | 180.0° |
| C26 | C25 | H20 | H21 | 118.8° | 120.1° |
| C25 | C26 | H22 | H23 | 119.7° | 120.0° |
| C11 | C10 | C13 | N17 | 28.2° | 5.0° |
| C11 | C10 | C13 | C14 | 152.5° | 174.8° |
| C11 | C10 | C09 | H8 | 179.6° | 180.0° |
| C10 | C11 | C12 | H10 | 179.4° | 179.7° |
| C26 | C21 | C22 | C23 | 66.2° | 60.0° |
| C26 | C21 | C22 | N20 | 123.1° | 120.0° |
| C26 | C21 | C22 | H13 | 116.5° | 120.1° |
| C26 | C21 | N20 | H13 | 115.8° | 120.0° |
| C26 | C21 | N20 | C19 | 122.8° | 85.1° |
| C26 | C21 | N20 | H12 | 0.2° | 95.0° |
| C26 | C21 | C22 | H14 | 174.3° | 60.0° |
| C26 | C21 | C22 | H15 | 53.3° | 180.0° |
| C21 | C26 | C25 | H20 | 169.0° | 180.0° |
| C21 | C26 | C25 | H21 | 71.8° | 59.9° |
| C21 | C26 | H22 | H23 | 119.6° | 120.0° |
| C10 | C13 | N17 | C14 | 179.4° | 179.8° |
| C10 | C13 | N17 | N18 | 0.4° | 0.1° |
| C10 | C13 | N17 | C16 | 179.8° | 179.8° |
| C10 | C13 | C14 | N15 | 179.8° | 180.0° |
| C13 | C10 | C09 | H8 | 0.1° | 0.0° |
| C13 | C10 | C11 | H9 | 0.2° | 0.1° |
| C10 | C13 | C14 | H11 | 0.2° | 0.0° |
| C23 | C22 | C21 | H14 | 119.5° | 120.0° |
| C23 | C22 | C21 | H15 | 119.5° | 120.0° |
| C23 | C22 | C21 | N20 | 170.8° | 180.0° |
| C23 | C22 | C21 | H13 | 50.4° | 60.0° |
| C23 | C22 | H14 | H15 | 121.5° | 119.9° |
| C22 | C23 | H16 | H17 | 118.0° | 120.0° |
| C22 | C23 | C24 | H18 | 164.4° | 60.1° |
| C22 | C23 | C24 | H19 | 77.6° | 180.0° |
| C22 | C21 | N20 | H13 | 120.0° | 120.0° |
| C22 | C21 | N20 | C19 | 1.4° | 155.0° |
| C22 | C21 | N20 | H12 | 124.0° | 24.9° |
| C21 | C22 | H14 | H15 | 121.5° | 120.1° |
| C21 | C22 | C23 | H16 | 66.0° | 180.0° |
| C21 | C22 | C23 | H17 | 175.3° | 60.0° |
| C22 | C21 | C26 | H22 | 55.3° | 180.0° |
| C22 | C21 | C26 | H23 | 175.0° | 60.0° |
| C21 | N20 | C19 | N18 | 29.7° | 0.0° |
| C21 | N20 | C19 | H12 | 122.6° | 179.9° |
| C21 | N20 | C19 | C27 | 151.6° | 179.9° |
| N20 | C21 | C22 | H14 | 51.3° | 60.0° |
| N20 | C21 | C22 | H15 | 69.8° | 60.1° |
| N20 | C21 | C26 | H22 | 71.6° | 60.1° |
| N20 | C21 | C26 | H23 | 48.1° | 59.9° |
| C13 | N17 | N18 | C16 | 179.4° | 179.9° |
| C13 | N17 | N18 | C19 | 179.7° | 180.0° |
| N17 | C13 | C14 | N15 | 0.4° | 0.2° |
| C13 | N17 | C16 | N15 | 0.2° | 0.4° |
| C13 | N17 | C16 | C28 | 179.9° | 179.8° |
| N17 | C13 | C14 | H11 | 179.6° | 179.7° |
| C14 | C13 | N17 | N18 | 179.0° | 179.7° |
| C14 | C13 | N17 | C16 | 0.4° | 0.4° |
| C13 | C14 | N15 | H11 | 180.0° | 180.0° |
| C13 | C14 | N15 | C16 | 0.3° | 0.0° |
| N17 | N18 | C19 | N20 | 179.3° | 179.9° |
| N17 | N18 | C19 | C27 | 0.7° | 0.0° |
| N18 | N17 | C16 | N15 | 179.3° | 179.7° |
| N18 | N17 | C16 | C28 | 0.6° | 0.1° |
| N18 | C19 | N20 | C27 | 178.7° | 179.9° |
| C19 | N18 | N17 | C16 | 1.0° | 0.2° |
| N18 | C19 | C27 | C28 | 0.1° | 0.3° |
| N18 | C19 | N20 | H12 | 92.9° | 179.9° |
| N18 | C19 | C27 | H24 | 179.9° | 180.0° |
| N20 | C19 | C27 | C28 | 178.9° | 179.6° |
| C19 | N20 | C21 | H13 | 121.4° | 35.0° |
| N20 | C19 | C27 | H24 | 1.1° | 0.1° |
| N17 | C16 | N15 | C14 | 0.0° | 0.3° |
| N17 | C16 | N15 | C28 | 179.9° | 179.7° |
| N17 | C16 | C28 | C27 | 0.0° | 0.4° |
| N17 | C16 | C28 | N29 | 179.4° | 179.7° |
| C14 | N15 | C16 | C28 | 179.8° | 180.0° |
| C19 | C27 | C28 | C16 | 0.2° | 0.6° |
| C19 | C27 | C28 | H24 | 180.0° | 179.7° |
| C19 | C27 | C28 | N29 | 179.7° | 179.8° |
| C27 | C19 | N20 | H12 | 85.8° | 0.1° |
| N15 | C16 | C28 | C27 | 179.8° | 179.3° |
| N15 | C16 | C28 | N29 | 0.7° | 0.0° |
| C16 | N15 | C14 | H11 | 179.7° | 180.0° |
| C16 | C28 | C27 | N29 | 179.5° | 179.2° |
| C16 | C28 | N29 | C30 | 172.1° | 180.0° |
| C16 | C28 | C27 | H24 | 179.8° | 179.7° |
| C16 | C28 | N29 | H25 | 51.0° | 0.0° |
| C27 | C28 | N29 | C30 | 7.4° | 0.8° |
| C27 | C28 | N29 | H25 | 128.5° | 179.3° |
| C28 | N29 | C30 | H25 | 121.2° | 179.9° |
| C28 | N29 | C30 | C31 | 98.5° | 180.0° |
| N29 | C28 | C27 | H24 | 0.3° | 0.5° |
| C28 | N29 | C30 | H26 | 141.0° | 60.1° |
| C28 | N29 | C30 | H27 | 22.1° | 60.0° |
| N29 | C30 | C31 | H26 | 120.6° | 120.0° |
| N29 | C30 | C31 | H27 | 120.5° | 120.1° |
| N29 | C30 | C31 | C36 | 147.3° | 175.0° |
| N29 | C30 | C31 | C32 | 87.8° | 65.4° |
| N29 | C30 | H26 | H27 | 118.2° | 120.1° |
| N29 | C30 | C31 | H28 | 30.1° | 54.8° |
| C30 | C31 | C36 | C32 | 118.6° | 119.9° |
| C30 | C31 | C36 | H28 | 116.6° | 120.2° |
| C30 | C31 | C32 | H28 | 117.4° | 120.1° |
| C30 | C31 | C36 | C35 | 157.6° | 176.8° |
| C30 | C31 | C32 | C33 | 153.9° | 176.8° |
| C31 | C30 | N29 | H25 | 22.7° | 0.0° |
| C31 | C30 | H26 | H27 | 118.3° | 119.9° |
| C30 | C31 | C32 | H29 | 85.1° | 63.2° |
| C30 | C31 | C32 | H30 | 32.8° | 57.0° |
| C30 | C31 | C36 | H35 | 36.9° | 56.9° |
| C30 | C31 | C36 | H36 | 81.8° | 63.2° |
| C36 | C31 | C32 | H28 | 124.8° | 120.0° |
| C31 | C36 | C35 | H35 | 120.6° | 119.9° |
| C31 | C36 | C35 | H36 | 120.6° | 119.9° |
| C36 | C31 | C32 | C33 | 36.1° | 57.0° |
| C31 | C36 | C35 | O34 | 48.1° | 57.6° |
| C36 | C31 | C30 | H26 | 92.1° | 65.0° |
| C36 | C31 | C30 | H27 | 26.8° | 55.0° |
| C36 | C31 | C32 | H29 | 157.1° | 176.9° |
| C36 | C31 | C32 | H30 | 84.9° | 62.9° |
| C31 | C36 | C35 | H33 | 168.4° | 62.3° |
| C31 | C36 | C35 | H34 | 72.3° | 177.6° |
| C31 | C36 | H35 | H36 | 118.1° | 120.1° |
| C32 | C31 | C36 | C35 | 38.9° | 57.0° |
| C31 | C32 | C33 | H29 | 121.0° | 119.9° |
| C31 | C32 | C33 | H30 | 121.0° | 119.9° |
| C31 | C32 | C33 | O34 | 41.2° | 57.6° |
| C32 | C31 | C30 | H26 | 32.8° | 54.6° |
| C32 | C31 | C30 | H27 | 151.6° | 174.5° |
| C31 | C32 | H29 | H30 | 116.8° | 120.2° |
| C31 | C32 | C33 | H31 | 79.1° | 62.4° |
| C31 | C32 | C33 | H32 | 161.6° | 177.6° |
| C32 | C31 | C36 | H35 | 81.7° | 62.9° |
| C32 | C31 | C36 | H36 | 159.5° | 176.9° |
| C36 | C35 | O34 | H33 | 120.3° | 119.9° |
| C36 | C35 | O34 | H34 | 120.4° | 120.1° |
| C36 | C35 | O34 | C33 | 56.1° | 61.1° |
| C35 | C36 | C31 | H28 | 85.8° | 63.0° |
| C36 | C35 | H33 | H34 | 118.9° | 120.1° |
| C35 | C36 | H35 | H36 | 118.0° | 120.1° |
| C32 | C33 | O34 | C35 | 51.9° | 61.2° |
| C32 | C33 | O34 | H31 | 120.3° | 120.0° |
| C32 | C33 | O34 | H32 | 120.4° | 120.0° |
| C33 | C32 | C31 | H28 | 88.7° | 63.0° |
| C33 | C32 | H29 | H30 | 116.8° | 120.2° |
| C32 | C33 | H31 | H32 | 119.0° | 120.0° |
| C35 | O34 | C33 | H31 | 68.4° | 58.8° |
| C35 | O34 | C33 | H32 | 172.2° | 178.8° |
| O34 | C35 | H33 | H34 | 118.9° | 120.0° |
| O34 | C35 | C36 | H35 | 72.5° | 62.4° |
| O34 | C35 | C36 | H36 | 168.7° | 177.5° |
| O34 | C33 | C32 | H29 | 162.2° | 177.5° |
| O34 | C33 | C32 | H30 | 79.8° | 62.3° |
| O34 | C33 | H31 | H32 | 119.0° | 120.0° |
| C33 | O34 | C35 | H33 | 176.4° | 58.8° |
| C33 | O34 | C35 | H34 | 64.3° | 178.8° |
| H1 | N03 | C04 | H2 | 125.0° | 170.6° |
| H2 | C04 | C05 | H3 | 1.6° | 144.9° |
| H2 | C04 | C05 | H4 | 142.6° | 0.0° |
| H2 | C04 | C06 | H5 | 142.6° | 0.1° |
| H2 | C04 | C06 | H6 | 1.3° | 145.0° |
| H3 | C05 | C06 | H5 | 141.1° | 145.0° |
| H3 | C05 | C06 | H6 | 0.1° | 0.0° |
| H4 | C05 | C06 | H5 | 0.1° | 0.0° |
| H4 | C05 | C06 | H6 | 141.2° | 145.1° |
| H7 | C08 | C09 | H8 | 0.3° | 0.0° |
| H9 | C11 | C12 | H10 | 0.6° | 0.1° |
| H12 | N20 | C21 | H13 | 116.0° | 144.9° |
| H13 | C21 | C22 | H14 | 69.1° | 180.0° |
| H13 | C21 | C22 | H15 | 169.8° | 59.9° |
| H13 | C21 | C26 | H22 | 171.9° | 59.9° |
| H13 | C21 | C26 | H23 | 68.3° | 180.0° |
| H14 | C22 | C23 | H16 | 53.6° | 60.0° |
| H14 | C22 | C23 | H17 | 65.1° | 180.0° |
| H15 | C22 | C23 | H16 | 174.6° | 60.0° |
| H15 | C22 | C23 | H17 | 55.9° | 60.0° |
| H16 | C23 | C24 | H18 | 43.8° | 59.9° |
| H16 | C23 | C24 | H19 | 161.8° | 60.0° |
| H17 | C23 | C24 | H18 | 74.9° | 180.0° |
| H17 | C23 | C24 | H19 | 43.1° | 60.0° |
| H18 | C24 | C25 | H20 | 79.4° | 59.9° |
| H18 | C24 | C25 | H21 | 39.9° | 179.9° |
| H19 | C24 | C25 | H20 | 38.6° | 60.0° |
| H19 | C24 | C25 | H21 | 157.8° | 60.0° |
| H20 | C25 | C26 | H22 | 48.9° | 60.1° |
| H20 | C25 | C26 | H23 | 70.9° | 60.0° |
| H21 | C25 | C26 | H22 | 168.1° | 60.0° |
| H21 | C25 | C26 | H23 | 48.3° | 180.0° |
| H25 | N29 | C30 | H26 | 97.9° | 120.0° |
| H25 | N29 | C30 | H27 | 143.3° | 120.0° |
| H26 | C30 | C31 | H28 | 150.7° | 174.7° |
| H27 | C30 | C31 | H28 | 90.5° | 65.3° |
| H28 | C31 | C32 | H29 | 32.3° | 56.9° |
| H28 | C31 | C32 | H30 | 150.3° | 177.1° |
| H28 | C31 | C36 | H35 | 153.6° | 177.1° |
| H28 | C31 | C36 | H36 | 34.8° | 57.0° |
| H29 | C32 | C33 | H31 | 41.9° | 57.5° |
| H29 | C32 | C33 | H32 | 77.4° | 62.5° |
| H30 | C32 | C33 | H31 | 159.9° | 177.7° |
| H30 | C32 | C33 | H32 | 40.5° | 57.7° |
| H33 | C35 | C36 | H35 | 47.8° | 177.7° |
| H33 | C35 | C36 | H36 | 70.9° | 57.6° |
| H34 | C35 | C36 | H35 | 167.1° | 57.7° |
| H34 | C35 | C36 | H36 | 48.4° | 62.4° |
