YHI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | sing | 1.54Å | 1.50Å | |
| C01 | C16 | sing | 1.57Å | 1.61Å | |
| C01 | C15 | sing | 1.54Å | 1.52Å | |
| C02 | N03 | sing | 1.48Å | 1.47Å | |
| C18 | C16 | sing | 1.53Å | 1.39Å | |
| C11 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C07 | sing | 1.38Å | 1.44Å | Aromatic |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C16 | C17 | sing | 1.53Å | 1.59Å | |
| C10 | C09 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | C14 | sing | 1.54Å | 1.48Å | |
| O05 | C06 | sing | 1.45Å | 1.45Å | |
| O05 | C04 | sing | 1.35Å | 1.39Å | |
| C07 | C06 | sing | 1.51Å | 1.53Å | |
| C07 | C08 | doub | 1.38Å | 1.44Å | Aromatic |
| O31 | C19 | doub | 1.21Å | 1.24Å | |
| N03 | C04 | sing | 1.35Å | 1.29Å | |
| N03 | C14 | sing | 1.48Å | 1.46Å | |
| C09 | C08 | sing | 1.38Å | 1.35Å | Aromatic |
| C04 | O13 | doub | 1.22Å | 1.20Å | |
| C14 | C19 | sing | 1.51Å | 1.58Å | |
| C19 | N20 | sing | 1.35Å | 1.47Å | |
| N20 | C21 | sing | 1.46Å | 1.45Å | |
| C24 | C25 | sing | 1.55Å | 1.48Å | |
| C24 | C23 | sing | 1.55Å | 1.56Å | |
| C21 | C29 | sing | 1.53Å | 1.44Å | |
| C21 | C22 | sing | 1.53Å | 1.56Å | |
| C25 | N26 | sing | 1.47Å | 1.54Å | |
| C29 | O30 | sing | 1.43Å | 1.49Å | |
| C23 | C22 | sing | 1.53Å | 1.53Å | |
| C23 | C27 | sing | 1.51Å | 1.52Å | |
| N26 | C27 | sing | 1.34Å | 1.41Å | |
| C27 | O28 | doub | 1.21Å | 1.21Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C15 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C17 | H5 | sing | 1.09Å | 1.10Å | |
| C21 | H6 | sing | 1.09Å | 1.10Å | |
| C22 | H7 | sing | 1.09Å | 1.10Å | |
| C22 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C24 | H10 | sing | 1.09Å | 1.10Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| C02 | H12 | sing | 1.09Å | 1.10Å | |
| C02 | H13 | sing | 1.09Å | 1.10Å | |
| C06 | H14 | sing | 1.09Å | 1.10Å | |
| C06 | H15 | sing | 1.09Å | 1.10Å | |
| C08 | H16 | sing | 1.08Å | 1.08Å | |
| C09 | H17 | sing | 1.08Å | 1.08Å | |
| C11 | H18 | sing | 1.08Å | 1.08Å | |
| C12 | H19 | sing | 1.08Å | 1.08Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| N20 | H24 | sing | 0.97Å | 1.00Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C29 | H28 | sing | 1.09Å | 1.10Å | |
| O30 | H29 | sing | 0.97Å | 0.95Å | |
| C25 | H30 | sing | 1.09Å | 1.10Å | |
| N26 | H31 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C02 | C01 | C16 | 139.9° | 118.2° |
| C02 | C01 | C15 | 106.3° | 105.3° |
| C01 | C02 | N03 | 105.8° | 104.6° |
| C02 | C01 | H11 | 110.8° | 117.6° |
| C01 | C02 | H12 | 110.4° | 110.4° |
| C01 | C02 | H13 | 110.3° | 110.4° |
| C16 | C01 | C15 | 58.3° | 58.8° |
| C01 | C16 | C18 | 122.9° | 117.4° |
| C01 | C16 | C15 | 57.8° | 59.7° |
| C01 | C16 | C17 | 116.0° | 117.4° |
| C16 | C01 | H11 | 109.3° | 119.5° |
| C01 | C15 | C16 | 63.8° | 61.5° |
| C01 | C15 | C14 | 106.1° | 104.9° |
| C01 | C15 | H2 | 112.1° | 121.8° |
| C15 | C01 | H11 | 110.5° | 123.4° |
| C02 | N03 | C04 | 122.4° | 127.9° |
| C02 | N03 | C14 | 106.9° | 104.7° |
| N03 | C02 | H12 | 110.4° | 110.4° |
| N03 | C02 | H13 | 110.4° | 110.4° |
| C18 | C16 | C15 | 121.3° | 117.7° |
| C18 | C16 | C17 | 115.4° | 115.5° |
| C16 | C18 | H21 | 109.5° | 109.5° |
| C16 | C18 | H22 | 109.4° | 109.5° |
| C16 | C18 | H23 | 109.5° | 109.5° |
| C12 | C11 | C10 | 118.1° | 120.0° |
| C11 | C12 | C07 | 120.6° | 120.0° |
| C12 | C11 | H18 | 121.0° | 120.0° |
| C11 | C12 | H19 | 119.7° | 120.0° |
| C11 | C10 | C09 | 123.9° | 120.0° |
| C11 | C10 | H1 | 118.1° | 120.0° |
| C10 | C11 | H18 | 121.0° | 120.0° |
| C12 | C07 | C06 | 124.9° | 120.0° |
| C12 | C07 | C08 | 116.6° | 120.1° |
| C07 | C12 | H19 | 119.7° | 120.0° |
| C15 | C16 | C17 | 110.6° | 117.7° |
| C16 | C15 | C14 | 134.6° | 118.1° |
| C16 | C15 | H2 | 111.9° | 119.6° |
| C16 | C17 | H3 | 109.5° | 109.5° |
| C16 | C17 | H4 | 109.5° | 109.5° |
| C16 | C17 | H5 | 109.4° | 109.5° |
| C10 | C09 | C08 | 118.1° | 120.0° |
| C09 | C10 | H1 | 118.1° | 120.0° |
| C10 | C09 | H17 | 120.9° | 120.0° |
| C15 | C14 | N03 | 108.1° | 104.7° |
| C15 | C14 | C19 | 118.4° | 110.4° |
| C14 | C15 | H2 | 112.6° | 117.6° |
| C15 | C14 | H20 | 107.8° | 110.3° |
| C06 | O05 | C04 | 118.7° | 117.0° |
| O05 | C06 | C07 | 118.2° | 109.5° |
| O05 | C06 | H14 | 107.3° | 109.5° |
| O05 | C06 | H15 | 107.3° | 109.4° |
| O05 | C04 | N03 | 117.4° | 120.0° |
| O05 | C04 | O13 | 117.9° | 120.0° |
| C06 | C07 | C08 | 118.1° | 120.0° |
| C07 | C06 | H14 | 107.3° | 109.4° |
| C07 | C06 | H15 | 107.2° | 109.5° |
| C07 | C08 | C09 | 122.6° | 120.0° |
| C07 | C08 | H16 | 118.7° | 120.1° |
| O31 | C19 | C14 | 124.6° | 120.0° |
| O31 | C19 | N20 | 117.5° | 120.0° |
| C04 | N03 | C14 | 128.8° | 127.4° |
| N03 | C04 | O13 | 124.7° | 120.0° |
| N03 | C14 | C19 | 107.6° | 110.1° |
| N03 | C14 | H20 | 108.0° | 110.7° |
| C09 | C08 | H16 | 118.7° | 120.0° |
| C08 | C09 | H17 | 121.0° | 120.0° |
| C14 | C19 | N20 | 117.8° | 120.1° |
| C19 | C14 | H20 | 106.6° | 110.4° |
| C19 | N20 | C21 | 122.5° | 120.0° |
| C19 | N20 | H24 | 118.7° | 120.0° |
| N20 | C21 | C29 | 106.6° | 109.5° |
| N20 | C21 | C22 | 110.8° | 109.5° |
| N20 | C21 | H6 | 108.9° | 109.5° |
| C21 | N20 | H24 | 118.7° | 120.0° |
| C25 | C24 | C23 | 108.6° | 101.7° |
| C24 | C25 | N26 | 104.8° | 105.5° |
| C25 | C24 | H9 | 109.7° | 111.0° |
| C25 | C24 | H10 | 109.7° | 111.0° |
| C24 | C25 | H26 | 110.6° | 110.2° |
| C24 | C25 | H30 | 110.6° | 110.2° |
| C24 | C23 | C22 | 113.5° | 110.5° |
| C24 | C23 | C27 | 105.3° | 104.2° |
| C23 | C24 | H9 | 109.7° | 110.9° |
| C23 | C24 | H10 | 109.7° | 111.0° |
| C24 | C23 | H25 | 107.7° | 110.5° |
| C29 | C21 | C22 | 113.8° | 109.5° |
| C21 | C29 | O30 | 102.5° | 109.5° |
| C29 | C21 | H6 | 109.1° | 109.5° |
| C21 | C29 | H27 | 111.2° | 109.5° |
| C21 | C29 | H28 | 111.2° | 109.5° |
| C21 | C22 | C23 | 120.1° | 109.5° |
| C22 | C21 | H6 | 107.5° | 109.4° |
| C21 | C22 | H7 | 106.7° | 109.4° |
| C21 | C22 | H8 | 106.7° | 109.5° |
| C25 | N26 | C27 | 111.6° | 111.3° |
| N26 | C25 | H26 | 110.6° | 110.2° |
| N26 | C25 | H30 | 110.6° | 110.3° |
| C25 | N26 | H31 | 124.2° | 124.4° |
| O30 | C29 | H27 | 111.2° | 109.5° |
| O30 | C29 | H28 | 111.2° | 109.5° |
| C29 | O30 | H29 | 109.5° | 114.0° |
| C22 | C23 | C27 | 113.6° | 110.5° |
| C23 | C22 | H7 | 106.7° | 109.5° |
| C23 | C22 | H8 | 106.8° | 109.5° |
| C22 | C23 | H25 | 108.2° | 110.4° |
| C23 | C27 | N26 | 109.0° | 110.1° |
| C23 | C27 | O28 | 126.0° | 124.9° |
| C27 | C23 | H25 | 108.3° | 110.6° |
| N26 | C27 | O28 | 125.0° | 124.9° |
| C27 | N26 | H31 | 124.2° | 124.4° |
| H3 | C17 | H4 | 109.5° | 109.4° |
| H3 | C17 | H5 | 109.5° | 109.5° |
| H4 | C17 | H5 | 109.5° | 109.4° |
| H7 | C22 | H8 | 109.4° | 109.4° |
| H9 | C24 | H10 | 109.5° | 110.9° |
| H12 | C02 | H13 | 109.5° | 110.5° |
| H14 | C06 | H15 | 109.5° | 109.5° |
| H21 | C18 | H22 | 109.5° | 109.4° |
| H21 | C18 | H23 | 109.4° | 109.5° |
| H22 | C18 | H23 | 109.5° | 109.5° |
| H26 | C25 | H30 | 109.5° | 110.3° |
| H27 | C29 | H28 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C02 | C01 | C16 | C15 | 77.4° | 91.5° |
| C02 | C01 | C16 | H11 | 179.9° | 155.1° |
| C02 | C01 | C15 | H11 | 120.3° | 139.1° |
| C01 | C02 | N03 | H12 | 119.4° | 118.8° |
| C01 | C02 | N03 | H13 | 119.4° | 118.7° |
| C02 | C01 | C16 | C18 | 173.6° | 160.8° |
| C02 | C01 | C16 | C17 | 21.6° | 16.1° |
| C02 | C01 | C15 | C14 | 6.8° | 0.3° |
| C01 | C02 | N03 | C04 | 167.6° | 140.4° |
| C01 | C02 | N03 | C14 | 26.7° | 38.6° |
| C02 | C01 | C15 | H2 | 116.5° | 137.1° |
| C01 | C02 | H12 | H13 | 121.7° | 122.4° |
| C16 | C01 | C15 | H11 | 100.6° | 106.9° |
| C16 | C01 | C02 | N03 | 39.5° | 39.4° |
| C01 | C16 | C18 | C15 | 69.6° | 68.3° |
| C01 | C16 | C18 | C17 | 152.2° | 145.3° |
| C01 | C16 | C15 | C17 | 108.5° | 107.2° |
| C16 | C01 | C15 | C14 | 132.3° | 114.2° |
| C16 | C01 | C15 | H2 | 104.5° | 108.9° |
| C01 | C16 | C17 | H3 | 180.0° | 111.4° |
| C01 | C16 | C17 | H4 | 60.0° | 128.6° |
| C01 | C16 | C17 | H5 | 60.0° | 8.7° |
| C16 | C01 | C02 | H12 | 159.0° | 158.2° |
| C16 | C01 | C02 | H13 | 79.9° | 79.3° |
| C01 | C16 | C18 | H21 | 180.0° | 8.6° |
| C01 | C16 | C18 | H22 | 60.0° | 128.6° |
| C01 | C16 | C18 | H23 | 60.0° | 111.4° |
| C15 | C01 | C02 | N03 | 20.4° | 23.1° |
| C01 | C15 | C14 | H2 | 122.9° | 139.0° |
| C01 | C15 | C14 | N03 | 9.6° | 23.5° |
| C01 | C15 | C14 | C19 | 112.9° | 95.0° |
| C15 | C01 | C02 | H12 | 99.0° | 95.7° |
| C15 | C01 | C02 | H13 | 139.9° | 141.8° |
| C01 | C15 | C14 | H20 | 126.1° | 142.7° |
| C02 | N03 | C14 | C15 | 22.7° | 38.8° |
| C02 | N03 | C04 | O05 | 9.1° | 0.0° |
| C02 | N03 | C04 | C14 | 162.4° | 178.8° |
| C02 | N03 | C04 | O13 | 170.8° | 180.0° |
| C02 | N03 | C14 | C19 | 106.2° | 79.9° |
| N03 | C02 | C01 | H11 | 140.6° | 165.0° |
| N03 | C02 | H12 | H13 | 121.7° | 122.4° |
| C02 | N03 | C14 | H20 | 139.1° | 157.7° |
| C18 | C16 | C15 | C17 | 139.9° | 145.6° |
| C18 | C16 | C15 | C14 | 161.4° | 160.4° |
| C18 | C16 | C15 | H2 | 6.9° | 5.2° |
| C18 | C16 | C17 | H3 | 25.8° | 33.9° |
| C18 | C16 | C17 | H4 | 145.8° | 86.0° |
| C18 | C16 | C17 | H5 | 94.2° | 154.0° |
| C18 | C16 | C01 | H11 | 6.2° | 5.7° |
| C16 | C18 | H21 | H22 | 120.0° | 120.0° |
| C16 | C18 | H21 | H23 | 120.0° | 120.0° |
| C16 | C18 | H22 | H23 | 120.0° | 120.0° |
| C12 | C11 | C10 | H18 | 180.0° | 179.9° |
| C11 | C12 | C07 | H19 | 180.0° | 179.9° |
| C12 | C11 | C10 | C09 | 2.8° | 0.1° |
| C11 | C12 | C07 | C06 | 177.7° | 179.8° |
| C11 | C12 | C07 | C08 | 5.2° | 0.3° |
| C12 | C11 | C10 | H1 | 177.2° | 179.8° |
| C10 | C11 | C12 | C07 | 4.6° | 0.1° |
| C11 | C10 | C09 | H1 | 180.0° | 179.7° |
| C11 | C10 | C09 | C08 | 1.7° | 0.3° |
| C11 | C10 | C09 | H17 | 178.3° | 179.7° |
| C10 | C11 | C12 | H19 | 175.4° | 180.0° |
| C12 | C07 | C06 | O05 | 15.3° | 90.5° |
| C12 | C07 | C06 | C08 | 172.5° | 179.5° |
| C12 | C07 | C08 | C09 | 4.1° | 0.5° |
| C12 | C07 | C06 | H14 | 106.0° | 149.5° |
| C12 | C07 | C06 | H15 | 136.5° | 29.5° |
| C12 | C07 | C08 | H16 | 175.9° | 179.5° |
| C07 | C12 | C11 | H18 | 175.4° | 180.0° |
| C16 | C15 | C14 | H2 | 168.2° | 155.7° |
| C16 | C15 | C14 | N03 | 59.3° | 41.8° |
| C16 | C15 | C14 | C19 | 178.2° | 160.3° |
| C15 | C16 | C17 | H3 | 116.7° | 179.7° |
| C15 | C16 | C17 | H4 | 3.3° | 60.3° |
| C15 | C16 | C17 | H5 | 123.3° | 59.6° |
| C16 | C15 | C14 | H20 | 57.3° | 77.4° |
| C15 | C16 | C18 | H21 | 110.4° | 59.7° |
| C15 | C16 | C18 | H22 | 129.6° | 60.3° |
| C15 | C16 | C18 | H23 | 9.6° | 179.7° |
| C17 | C16 | C15 | C14 | 21.4° | 14.8° |
| C17 | C16 | C15 | H2 | 146.8° | 140.4° |
| C16 | C17 | H3 | H4 | 120.0° | 120.0° |
| C16 | C17 | H3 | H5 | 120.0° | 120.0° |
| C16 | C17 | H4 | H5 | 120.0° | 120.0° |
| C17 | C16 | C01 | H11 | 158.3° | 139.0° |
| C17 | C16 | C18 | H21 | 27.8° | 154.0° |
| C17 | C16 | C18 | H22 | 92.2° | 86.1° |
| C17 | C16 | C18 | H23 | 147.8° | 34.0° |
| C10 | C09 | C08 | C07 | 2.4° | 0.5° |
| C10 | C09 | C08 | H17 | 180.0° | 179.9° |
| C10 | C09 | C08 | H16 | 177.6° | 179.5° |
| C09 | C10 | C11 | H18 | 177.2° | 180.0° |
| C15 | C14 | C19 | O31 | 71.5° | 100.0° |
| C15 | C14 | N03 | C04 | 172.7° | 140.2° |
| C15 | C14 | N03 | C19 | 128.9° | 118.7° |
| C15 | C14 | N03 | H20 | 116.4° | 118.9° |
| C15 | C14 | C19 | H20 | 121.5° | 122.3° |
| C15 | C14 | C19 | N20 | 110.4° | 79.9° |
| C14 | C15 | C01 | H11 | 127.1° | 138.9° |
| O05 | C06 | C07 | H14 | 121.3° | 120.0° |
| O05 | C06 | C07 | H15 | 121.2° | 120.0° |
| O05 | C06 | C07 | C08 | 172.3° | 90.0° |
| C06 | O05 | C04 | N03 | 157.7° | 180.0° |
| C06 | O05 | C04 | O13 | 22.2° | 0.0° |
| O05 | C06 | H14 | H15 | 116.1° | 120.0° |
| C04 | O05 | C06 | C07 | 69.1° | 180.0° |
| O05 | C04 | N03 | O13 | 179.9° | 180.0° |
| O05 | C04 | N03 | C14 | 171.6° | 178.8° |
| C04 | O05 | C06 | H14 | 169.6° | 60.0° |
| C04 | O05 | C06 | H15 | 52.1° | 60.1° |
| C06 | C07 | C08 | C09 | 177.2° | 180.0° |
| C07 | C06 | H14 | H15 | 116.0° | 120.0° |
| C06 | C07 | C08 | H16 | 2.8° | 0.0° |
| C06 | C07 | C12 | H19 | 2.3° | 0.3° |
| C07 | C08 | C09 | H16 | 180.0° | 180.0° |
| C08 | C07 | C06 | H14 | 66.5° | 30.0° |
| C08 | C07 | C06 | H15 | 51.0° | 150.0° |
| C07 | C08 | C09 | H17 | 177.6° | 179.5° |
| C08 | C07 | C12 | H19 | 174.8° | 179.8° |
| O31 | C19 | C14 | N03 | 51.3° | 15.1° |
| O31 | C19 | C14 | N20 | 178.1° | 179.9° |
| O31 | C19 | N20 | C21 | 0.5° | 0.0° |
| O31 | C19 | C14 | H20 | 167.0° | 137.7° |
| O31 | C19 | N20 | H24 | 179.5° | 179.9° |
| C04 | N03 | C14 | C19 | 58.4° | 101.1° |
| C04 | N03 | C02 | H12 | 73.0° | 100.8° |
| C04 | N03 | C02 | H13 | 48.2° | 21.7° |
| C04 | N03 | C14 | H20 | 56.4° | 21.3° |
| C14 | N03 | C04 | O13 | 8.3° | 1.2° |
| N03 | C14 | C19 | H20 | 115.7° | 122.6° |
| N03 | C14 | C19 | N20 | 126.8° | 165.0° |
| N03 | C14 | C15 | H2 | 132.5° | 162.5° |
| C14 | N03 | C02 | H12 | 92.7° | 80.2° |
| C14 | N03 | C02 | H13 | 146.1° | 157.3° |
| C08 | C09 | C10 | H1 | 178.3° | 180.0° |
| C14 | C19 | N20 | C21 | 177.7° | 180.0° |
| C19 | C14 | C15 | H2 | 10.0° | 44.1° |
| C14 | C19 | N20 | H24 | 2.3° | 0.0° |
| C19 | N20 | C21 | H24 | 180.0° | 180.0° |
| C19 | N20 | C21 | C29 | 122.1° | 86.4° |
| C19 | N20 | C21 | C22 | 113.6° | 153.6° |
| C19 | N20 | C21 | H6 | 4.5° | 33.7° |
| N20 | C19 | C14 | H20 | 11.1° | 42.4° |
| N20 | C21 | C29 | C22 | 122.4° | 120.0° |
| N20 | C21 | C29 | H6 | 117.4° | 120.0° |
| N20 | C21 | C22 | H6 | 118.9° | 119.9° |
| N20 | C21 | C29 | O30 | 175.3° | 65.0° |
| N20 | C21 | C22 | C23 | 58.4° | 63.3° |
| N20 | C21 | C22 | H7 | 63.1° | 56.7° |
| N20 | C21 | C22 | H8 | 179.9° | 176.7° |
| N20 | C21 | C29 | H27 | 65.9° | 55.0° |
| N20 | C21 | C29 | H28 | 56.4° | 175.0° |
| C25 | C24 | C23 | H9 | 119.9° | 118.1° |
| C25 | C24 | C23 | H10 | 119.8° | 118.1° |
| C24 | C25 | N26 | H26 | 119.3° | 119.0° |
| C24 | C25 | N26 | H30 | 119.2° | 119.0° |
| C25 | C24 | C23 | C22 | 131.4° | 143.5° |
| C25 | C24 | C23 | C27 | 6.5° | 24.8° |
| C24 | C25 | N26 | C27 | 7.3° | 17.0° |
| C25 | C24 | H9 | H10 | 120.4° | 123.9° |
| C25 | C24 | C23 | H25 | 108.9° | 94.0° |
| C24 | C25 | H26 | H30 | 122.1° | 122.0° |
| C24 | C25 | N26 | H31 | 172.7° | 163.0° |
| C24 | C23 | C22 | C21 | 67.0° | 65.4° |
| C23 | C24 | C25 | N26 | 8.2° | 25.4° |
| C24 | C23 | C22 | C27 | 120.3° | 114.8° |
| C24 | C23 | C22 | H25 | 119.5° | 122.5° |
| C24 | C23 | C27 | H25 | 115.0° | 118.8° |
| C24 | C23 | C27 | N26 | 1.9° | 16.2° |
| C24 | C23 | C27 | O28 | 177.3° | 163.8° |
| C24 | C23 | C22 | H7 | 171.5° | 174.6° |
| C24 | C23 | C22 | H8 | 54.5° | 54.6° |
| C23 | C24 | H9 | H10 | 120.4° | 123.8° |
| C23 | C24 | C25 | H26 | 127.5° | 144.4° |
| C23 | C24 | C25 | H30 | 111.1° | 93.6° |
| C29 | C21 | C22 | H6 | 121.0° | 120.0° |
| C21 | C29 | O30 | H27 | 118.9° | 120.0° |
| C21 | C29 | O30 | H28 | 118.9° | 120.0° |
| C29 | C21 | C22 | C23 | 178.5° | 176.7° |
| C29 | C21 | C22 | H7 | 57.0° | 63.3° |
| C29 | C21 | C22 | H8 | 60.0° | 56.6° |
| C29 | C21 | N20 | H24 | 57.9° | 93.6° |
| C21 | C29 | H27 | H28 | 123.2° | 120.0° |
| C21 | C29 | O30 | H29 | 180.0° | 180.0° |
| C22 | C21 | C29 | O30 | 62.3° | 55.0° |
| C21 | C22 | C23 | H7 | 121.5° | 120.0° |
| C21 | C22 | C23 | H8 | 121.5° | 120.0° |
| C21 | C22 | C23 | C27 | 172.7° | 179.8° |
| C21 | C22 | H7 | H8 | 115.2° | 120.0° |
| C22 | C21 | N20 | H24 | 66.4° | 26.4° |
| C21 | C22 | C23 | H25 | 52.5° | 57.1° |
| C22 | C21 | C29 | H27 | 56.6° | 175.0° |
| C22 | C21 | C29 | H28 | 178.8° | 65.0° |
| C25 | N26 | C27 | C23 | 3.3° | 0.4° |
| C25 | N26 | C27 | H31 | 180.0° | 179.9° |
| C25 | N26 | C27 | O28 | 177.4° | 179.5° |
| N26 | C25 | C24 | H9 | 128.1° | 92.6° |
| N26 | C25 | C24 | H10 | 111.6° | 143.5° |
| N26 | C25 | H26 | H30 | 122.2° | 122.0° |
| O30 | C29 | C21 | H6 | 57.8° | 174.9° |
| O30 | C29 | H27 | H28 | 123.3° | 120.0° |
| C22 | C23 | C27 | H25 | 120.2° | 122.6° |
| C22 | C23 | C27 | N26 | 126.7° | 134.9° |
| C22 | C23 | C27 | O28 | 52.5° | 45.1° |
| C23 | C22 | C21 | H6 | 60.5° | 56.7° |
| C23 | C22 | H7 | H8 | 115.2° | 120.0° |
| C22 | C23 | C24 | H9 | 108.8° | 25.4° |
| C22 | C23 | C24 | H10 | 11.5° | 98.4° |
| C23 | C27 | N26 | O28 | 179.3° | 179.9° |
| C27 | C23 | C22 | H7 | 51.2° | 59.8° |
| C27 | C23 | C22 | H8 | 65.8° | 60.2° |
| C27 | C23 | C24 | H9 | 126.4° | 93.3° |
| C27 | C23 | C24 | H10 | 113.3° | 142.9° |
| C23 | C27 | N26 | H31 | 176.7° | 179.6° |
| N26 | C27 | C23 | H25 | 113.1° | 102.5° |
| C27 | N26 | C25 | H26 | 126.6° | 136.0° |
| C27 | N26 | C25 | H30 | 111.9° | 102.0° |
| O28 | C27 | C23 | H25 | 67.6° | 77.4° |
| O28 | C27 | N26 | H31 | 2.6° | 0.4° |
| H1 | C10 | C09 | H17 | 1.7° | 0.0° |
| H1 | C10 | C11 | H18 | 2.8° | 0.3° |
| H2 | C15 | C01 | H11 | 3.9° | 2.0° |
| H2 | C15 | C14 | H20 | 110.9° | 78.3° |
| H3 | C17 | H4 | H5 | 120.0° | 120.0° |
| H6 | C21 | C22 | H7 | 178.0° | 176.7° |
| H6 | C21 | C22 | H8 | 61.0° | 63.4° |
| H6 | C21 | N20 | H24 | 175.5° | 146.3° |
| H6 | C21 | C29 | H27 | 176.7° | 65.0° |
| H6 | C21 | C29 | H28 | 61.1° | 55.0° |
| H7 | C22 | C23 | H25 | 69.0° | 62.9° |
| H8 | C22 | C23 | H25 | 174.0° | 177.1° |
| H9 | C24 | C23 | H25 | 11.0° | 147.9° |
| H9 | C24 | C25 | H26 | 112.7° | 26.4° |
| H9 | C24 | C25 | H30 | 8.8° | 148.3° |
| H10 | C24 | C23 | H25 | 131.3° | 24.1° |
| H10 | C24 | C25 | H26 | 7.6° | 97.5° |
| H10 | C24 | C25 | H30 | 129.1° | 24.5° |
| H11 | C01 | C02 | H12 | 21.2° | 46.2° |
| H11 | C01 | C02 | H13 | 100.0° | 76.3° |
| H16 | C08 | C09 | H17 | 2.4° | 0.5° |
| H18 | C11 | C12 | H19 | 4.6° | 0.1° |
| H21 | C18 | H22 | H23 | 120.0° | 119.9° |
| H26 | C25 | N26 | H31 | 53.4° | 44.1° |
| H27 | C29 | O30 | H29 | 61.1° | 60.0° |
| H28 | C29 | O30 | H29 | 61.1° | 60.1° |
| H30 | C25 | N26 | H31 | 68.1° | 77.9° |
