7HZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C11 | doub | 1.36Å | 1.37Å | Aromatic |
| C10 | C09 | sing | 1.39Å | 1.40Å | Aromatic |
| C11 | C12 | sing | 1.41Å | 1.42Å | Aromatic |
| C09 | C08 | doub | 1.36Å | 1.37Å | Aromatic |
| C12 | C17 | doub | 1.40Å | 1.43Å | Aromatic |
| C12 | C13 | sing | 1.42Å | 1.36Å | Aromatic |
| C08 | C13 | sing | 1.41Å | 1.44Å | Aromatic |
| C08 | C07 | sing | 1.51Å | 1.52Å | |
| C17 | C16 | sing | 1.36Å | 1.37Å | Aromatic |
| C13 | C14 | doub | 1.41Å | 1.41Å | Aromatic |
| C07 | N06 | sing | 1.47Å | 1.45Å | |
| N06 | C05 | sing | 1.35Å | 1.37Å | |
| C16 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.36Å | 1.37Å | Aromatic |
| C21 | O20 | sing | 1.43Å | 1.42Å | |
| C05 | C04 | sing | 1.51Å | 1.55Å | |
| C05 | O18 | doub | 1.21Å | 1.25Å | |
| O20 | C19 | sing | 1.43Å | 1.41Å | |
| C04 | C19 | sing | 1.53Å | 1.53Å | |
| C04 | N03 | sing | 1.47Å | 1.43Å | |
| O01 | C02 | doub | 1.21Å | 1.25Å | |
| C02 | N03 | sing | 1.35Å | 1.36Å | |
| C02 | C22 | sing | 1.51Å | 1.48Å | |
| C38 | C37 | sing | 1.51Å | 1.48Å | |
| C39 | C37 | doub | 1.35Å | 1.40Å | Aromatic |
| C39 | C34 | sing | 1.42Å | 1.47Å | Aromatic |
| N32 | C22 | sing | 1.46Å | 1.45Å | |
| N32 | C33 | sing | 1.35Å | 1.38Å | |
| C23 | C22 | sing | 1.53Å | 1.54Å | |
| C23 | C24 | sing | 1.51Å | 1.49Å | |
| C37 | O36 | sing | 1.34Å | 1.37Å | Aromatic |
| C34 | C33 | sing | 1.48Å | 1.49Å | |
| C34 | N35 | doub | 1.31Å | 1.35Å | Aromatic |
| C33 | O40 | doub | 1.22Å | 1.25Å | |
| C24 | N25 | sing | 1.35Å | 1.42Å | |
| C24 | O31 | doub | 1.21Å | 1.25Å | |
| O36 | N35 | sing | 1.21Å | 1.34Å | Aromatic |
| C30 | C27 | sing | 1.53Å | 1.53Å | |
| N25 | O26 | sing | 1.42Å | 1.37Å | |
| C28 | C27 | sing | 1.53Å | 1.51Å | |
| C27 | O26 | sing | 1.43Å | 1.44Å | |
| C27 | C29 | sing | 1.53Å | 1.52Å | |
| N03 | H1 | sing | 0.97Å | 1.00Å | |
| C04 | H2 | sing | 1.09Å | 1.10Å | |
| N06 | H3 | sing | 0.97Å | 1.00Å | |
| C07 | H4 | sing | 1.09Å | 1.10Å | |
| C07 | H5 | sing | 1.09Å | 1.10Å | |
| C09 | H6 | sing | 1.08Å | 1.08Å | |
| C10 | H7 | sing | 1.08Å | 1.08Å | |
| C11 | H8 | sing | 1.08Å | 1.08Å | |
| C14 | H9 | sing | 1.08Å | 1.08Å | |
| C15 | H10 | sing | 1.08Å | 1.08Å | |
| C16 | H11 | sing | 1.08Å | 1.08Å | |
| C17 | H12 | sing | 1.08Å | 1.08Å | |
| C19 | H13 | sing | 1.09Å | 1.10Å | |
| C19 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.09Å | 1.10Å | |
| C21 | H17 | sing | 1.09Å | 1.10Å | |
| C22 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| N25 | H21 | sing | 0.97Å | 1.00Å | |
| C28 | H22 | sing | 1.09Å | 1.10Å | |
| C28 | H23 | sing | 1.09Å | 1.10Å | |
| C28 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C30 | H28 | sing | 1.09Å | 1.10Å | |
| C30 | H29 | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| N32 | H31 | sing | 0.97Å | 1.00Å | |
| C38 | H32 | sing | 1.09Å | 1.10Å | |
| C38 | H33 | sing | 1.09Å | 1.10Å | |
| C38 | H34 | sing | 1.09Å | 1.10Å | |
| C39 | H35 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C11 | C10 | C09 | 120.1° | 121.0° |
| C10 | C11 | C12 | 119.8° | 119.6° |
| C11 | C10 | H7 | 120.0° | 119.5° |
| C10 | C11 | H8 | 120.1° | 120.2° |
| C10 | C09 | C08 | 121.7° | 121.0° |
| C10 | C09 | H6 | 119.2° | 119.6° |
| C09 | C10 | H7 | 120.0° | 119.5° |
| C11 | C12 | C17 | 119.5° | 121.2° |
| C11 | C12 | C13 | 119.6° | 119.4° |
| C12 | C11 | H8 | 120.1° | 120.2° |
| C09 | C08 | C13 | 117.1° | 119.6° |
| C09 | C08 | C07 | 118.2° | 120.2° |
| C08 | C09 | H6 | 119.1° | 119.4° |
| C17 | C12 | C13 | 120.9° | 119.4° |
| C12 | C17 | C16 | 120.7° | 119.6° |
| C12 | C17 | H12 | 119.7° | 120.2° |
| C12 | C13 | C08 | 121.7° | 119.4° |
| C12 | C13 | C14 | 117.2° | 119.4° |
| C13 | C08 | C07 | 124.6° | 120.2° |
| C08 | C13 | C14 | 121.1° | 121.2° |
| C08 | C07 | N06 | 120.0° | 109.4° |
| C08 | C07 | H4 | 106.8° | 109.5° |
| C08 | C07 | H5 | 106.8° | 109.5° |
| C17 | C16 | C15 | 118.9° | 121.0° |
| C17 | C16 | H11 | 120.5° | 119.5° |
| C16 | C17 | H12 | 119.7° | 120.2° |
| C13 | C14 | C15 | 122.4° | 119.6° |
| C13 | C14 | H9 | 118.8° | 120.2° |
| C07 | N06 | C05 | 126.4° | 120.0° |
| C07 | N06 | H3 | 116.8° | 120.0° |
| N06 | C07 | H4 | 106.8° | 109.5° |
| N06 | C07 | H5 | 106.8° | 109.5° |
| N06 | C05 | C04 | 124.3° | 120.0° |
| N06 | C05 | O18 | 120.6° | 120.0° |
| C05 | N06 | H3 | 116.8° | 120.0° |
| C16 | C15 | C14 | 119.9° | 121.0° |
| C16 | C15 | H10 | 120.0° | 119.5° |
| C15 | C16 | H11 | 120.5° | 119.5° |
| C15 | C14 | H9 | 118.8° | 120.1° |
| C14 | C15 | H10 | 120.1° | 119.6° |
| C21 | O20 | C19 | 110.5° | 114.0° |
| O20 | C21 | H15 | 109.5° | 109.5° |
| O20 | C21 | H16 | 109.5° | 109.5° |
| O20 | C21 | H17 | 109.5° | 109.5° |
| C04 | C05 | O18 | 115.1° | 120.0° |
| C05 | C04 | C19 | 110.0° | 109.4° |
| C05 | C04 | N03 | 109.4° | 109.5° |
| C05 | C04 | H2 | 108.7° | 109.5° |
| O20 | C19 | C04 | 109.1° | 109.5° |
| O20 | C19 | H13 | 109.6° | 109.4° |
| O20 | C19 | H14 | 109.6° | 109.5° |
| C19 | C04 | N03 | 109.5° | 109.5° |
| C19 | C04 | H2 | 108.9° | 109.5° |
| C04 | C19 | H13 | 109.6° | 109.5° |
| C04 | C19 | H14 | 109.5° | 109.5° |
| C04 | N03 | C02 | 120.5° | 120.0° |
| C04 | N03 | H1 | 119.7° | 120.0° |
| N03 | C04 | H2 | 110.3° | 109.5° |
| O01 | C02 | N03 | 115.8° | 120.0° |
| O01 | C02 | C22 | 115.8° | 120.0° |
| N03 | C02 | C22 | 128.3° | 120.0° |
| C02 | N03 | H1 | 119.7° | 120.1° |
| C02 | C22 | N32 | 107.5° | 109.5° |
| C02 | C22 | C23 | 108.1° | 109.5° |
| C02 | C22 | H18 | 109.5° | 109.5° |
| C38 | C37 | C39 | 130.3° | 126.7° |
| C38 | C37 | O36 | 123.9° | 126.7° |
| C37 | C38 | H32 | 109.5° | 109.4° |
| C37 | C38 | H33 | 109.5° | 109.5° |
| C37 | C38 | H34 | 109.5° | 109.4° |
| C37 | C39 | C34 | 106.5° | 103.9° |
| C39 | C37 | O36 | 105.9° | 106.7° |
| C37 | C39 | H35 | 126.8° | 128.0° |
| C39 | C34 | C33 | 127.4° | 127.0° |
| C39 | C34 | N35 | 106.4° | 106.1° |
| C34 | C39 | H35 | 126.7° | 128.0° |
| C22 | N32 | C33 | 124.2° | 120.0° |
| N32 | C22 | C23 | 113.1° | 109.5° |
| N32 | C22 | H18 | 109.9° | 109.5° |
| C22 | N32 | H31 | 117.9° | 120.0° |
| N32 | C33 | C34 | 127.1° | 120.0° |
| N32 | C33 | O40 | 115.5° | 120.0° |
| C33 | N32 | H31 | 117.9° | 120.0° |
| C22 | C23 | C24 | 121.4° | 109.5° |
| C23 | C22 | H18 | 108.7° | 109.4° |
| C22 | C23 | H19 | 106.4° | 109.5° |
| C22 | C23 | H20 | 106.4° | 109.5° |
| C23 | C24 | N25 | 120.9° | 120.0° |
| C23 | C24 | O31 | 119.3° | 120.0° |
| C24 | C23 | H19 | 106.4° | 109.5° |
| C24 | C23 | H20 | 106.4° | 109.5° |
| C37 | O36 | N35 | 111.9° | 111.8° |
| C33 | C34 | N35 | 126.1° | 126.9° |
| C34 | C33 | O40 | 117.4° | 120.0° |
| C34 | N35 | O36 | 109.3° | 111.5° |
| N25 | C24 | O31 | 119.8° | 120.0° |
| C24 | N25 | O26 | 123.3° | 120.0° |
| C24 | N25 | H21 | 118.4° | 120.0° |
| C30 | C27 | C28 | 109.6° | 109.5° |
| C30 | C27 | O26 | 108.7° | 109.4° |
| C30 | C27 | C29 | 107.4° | 109.5° |
| C27 | C30 | H28 | 109.5° | 109.5° |
| C27 | C30 | H29 | 109.5° | 109.4° |
| C27 | C30 | H30 | 109.5° | 109.5° |
| N25 | O26 | C27 | 113.7° | 114.0° |
| O26 | N25 | H21 | 118.3° | 120.0° |
| C28 | C27 | O26 | 112.8° | 109.5° |
| C28 | C27 | C29 | 108.8° | 109.5° |
| C27 | C28 | H22 | 109.5° | 109.4° |
| C27 | C28 | H23 | 109.4° | 109.5° |
| C27 | C28 | H24 | 109.4° | 109.5° |
| O26 | C27 | C29 | 109.3° | 109.5° |
| C27 | C29 | H25 | 109.5° | 109.5° |
| C27 | C29 | H26 | 109.4° | 109.5° |
| C27 | C29 | H27 | 109.5° | 109.5° |
| H4 | C07 | H5 | 109.5° | 109.5° |
| H13 | C19 | H14 | 109.5° | 109.5° |
| H15 | C21 | H16 | 109.4° | 109.5° |
| H15 | C21 | H17 | 109.5° | 109.5° |
| H16 | C21 | H17 | 109.4° | 109.5° |
| H19 | C23 | H20 | 109.5° | 109.4° |
| H22 | C28 | H23 | 109.5° | 109.5° |
| H22 | C28 | H24 | 109.5° | 109.4° |
| H23 | C28 | H24 | 109.5° | 109.5° |
| H25 | C29 | H26 | 109.5° | 109.5° |
| H25 | C29 | H27 | 109.5° | 109.4° |
| H26 | C29 | H27 | 109.5° | 109.4° |
| H28 | C30 | H29 | 109.5° | 109.5° |
| H28 | C30 | H30 | 109.5° | 109.5° |
| H29 | C30 | H30 | 109.5° | 109.5° |
| H32 | C38 | H33 | 109.5° | 109.5° |
| H32 | C38 | H34 | 109.5° | 109.5° |
| H33 | C38 | H34 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C11 | C10 | C09 | H7 | 180.0° | 179.9° |
| C10 | C11 | C12 | H8 | 180.0° | 179.6° |
| C11 | C10 | C09 | C08 | 0.1° | 0.5° |
| C10 | C11 | C12 | C17 | 179.9° | 179.7° |
| C10 | C11 | C12 | C13 | 0.2° | 0.4° |
| C11 | C10 | C09 | H6 | 179.9° | 179.9° |
| C09 | C10 | C11 | C12 | 0.3° | 0.1° |
| C10 | C09 | C08 | H6 | 180.0° | 179.4° |
| C10 | C09 | C08 | C13 | 0.6° | 0.9° |
| C10 | C09 | C08 | C07 | 178.9° | 179.7° |
| C09 | C10 | C11 | H8 | 179.7° | 179.7° |
| C11 | C12 | C17 | C13 | 179.7° | 179.9° |
| C11 | C12 | C13 | C08 | 0.4° | 0.0° |
| C11 | C12 | C17 | C16 | 179.9° | 180.0° |
| C11 | C12 | C13 | C14 | 180.0° | 179.9° |
| C12 | C11 | C10 | H7 | 179.7° | 180.0° |
| C11 | C12 | C17 | H12 | 0.1° | 0.1° |
| C09 | C08 | C13 | C12 | 0.8° | 0.6° |
| C09 | C08 | C13 | C07 | 178.1° | 179.4° |
| C09 | C08 | C13 | C14 | 179.6° | 179.4° |
| C09 | C08 | C07 | N06 | 102.3° | 100.6° |
| C09 | C08 | C07 | H4 | 136.2° | 139.4° |
| C09 | C08 | C07 | H5 | 19.2° | 19.4° |
| C08 | C09 | C10 | H7 | 179.9° | 179.4° |
| C17 | C12 | C13 | C08 | 179.4° | 180.0° |
| C12 | C17 | C16 | H12 | 180.0° | 179.9° |
| C17 | C12 | C13 | C14 | 0.3° | 0.0° |
| C12 | C17 | C16 | C15 | 0.3° | 0.1° |
| C17 | C12 | C11 | H8 | 0.1° | 0.1° |
| C12 | C17 | C16 | H11 | 179.7° | 180.0° |
| C12 | C13 | C08 | C14 | 179.6° | 180.0° |
| C12 | C13 | C08 | C07 | 178.9° | 180.0° |
| C13 | C12 | C17 | C16 | 0.4° | 0.1° |
| C12 | C13 | C14 | C15 | 0.1° | 0.0° |
| C13 | C12 | C11 | H8 | 179.8° | 180.0° |
| C12 | C13 | C14 | H9 | 179.9° | 180.0° |
| C13 | C12 | C17 | H12 | 179.6° | 180.0° |
| C13 | C08 | C07 | N06 | 79.6° | 80.0° |
| C08 | C13 | C14 | C15 | 179.6° | 180.0° |
| C13 | C08 | C07 | H4 | 41.9° | 40.0° |
| C13 | C08 | C07 | H5 | 158.9° | 160.0° |
| C13 | C08 | C09 | H6 | 179.4° | 179.8° |
| C08 | C13 | C14 | H9 | 0.4° | 0.0° |
| C07 | C08 | C13 | C14 | 1.5° | 0.0° |
| C08 | C07 | N06 | H4 | 121.5° | 120.0° |
| C08 | C07 | N06 | H5 | 121.5° | 120.0° |
| C08 | C07 | N06 | C05 | 112.6° | 180.0° |
| C08 | C07 | N06 | H3 | 67.4° | 0.0° |
| C08 | C07 | H4 | H5 | 115.2° | 120.0° |
| C07 | C08 | C09 | H6 | 1.1° | 0.4° |
| C17 | C16 | C15 | H11 | 180.0° | 179.9° |
| C17 | C16 | C15 | C14 | 0.1° | 0.1° |
| C17 | C16 | C15 | H10 | 180.0° | 179.9° |
| C13 | C14 | C15 | C16 | 0.0° | 0.0° |
| C13 | C14 | C15 | H9 | 180.0° | 180.0° |
| C13 | C14 | C15 | H10 | 180.0° | 179.9° |
| C07 | N06 | C05 | H3 | 180.0° | 180.0° |
| C07 | N06 | C05 | C04 | 179.2° | 180.0° |
| C07 | N06 | C05 | O18 | 1.7° | 0.0° |
| N06 | C07 | H4 | H5 | 115.2° | 120.0° |
| N06 | C05 | C04 | O18 | 179.1° | 180.0° |
| N06 | C05 | C04 | C19 | 93.5° | 60.0° |
| N06 | C05 | C04 | N03 | 146.2° | 180.0° |
| N06 | C05 | C04 | H2 | 25.7° | 60.0° |
| C05 | N06 | C07 | H4 | 8.9° | 60.0° |
| C05 | N06 | C07 | H5 | 125.9° | 60.0° |
| C16 | C15 | C14 | H10 | 180.0° | 179.9° |
| C16 | C15 | C14 | H9 | 180.0° | 180.0° |
| C15 | C16 | C17 | H12 | 179.7° | 180.0° |
| C14 | C15 | C16 | H11 | 179.9° | 180.0° |
| C21 | O20 | C19 | C04 | 122.9° | 180.0° |
| C21 | O20 | C19 | H13 | 2.9° | 60.0° |
| C21 | O20 | C19 | H14 | 117.2° | 60.0° |
| O20 | C21 | H15 | H16 | 120.0° | 120.0° |
| O20 | C21 | H15 | H17 | 120.0° | 120.0° |
| O20 | C21 | H16 | H17 | 120.0° | 120.0° |
| C05 | C04 | C19 | O20 | 145.0° | 55.0° |
| C05 | C04 | C19 | N03 | 120.2° | 120.0° |
| C05 | C04 | C19 | H2 | 119.1° | 120.0° |
| C05 | C04 | N03 | H2 | 119.6° | 120.0° |
| C05 | C04 | N03 | C02 | 97.0° | 155.0° |
| C05 | C04 | N03 | H1 | 83.0° | 25.0° |
| C04 | C05 | N06 | H3 | 0.8° | 0.0° |
| C05 | C04 | C19 | H13 | 25.0° | 175.0° |
| C05 | C04 | C19 | H14 | 95.1° | 65.0° |
| O18 | C05 | C04 | C19 | 87.4° | 120.0° |
| O18 | C05 | C04 | N03 | 32.9° | 0.0° |
| O18 | C05 | C04 | H2 | 153.5° | 120.0° |
| O18 | C05 | N06 | H3 | 178.3° | 179.9° |
| O20 | C19 | C04 | H13 | 119.9° | 120.0° |
| O20 | C19 | C04 | H14 | 119.9° | 120.0° |
| O20 | C19 | C04 | N03 | 94.8° | 65.0° |
| O20 | C19 | C04 | H2 | 25.9° | 175.0° |
| O20 | C19 | H13 | H14 | 120.2° | 119.9° |
| C19 | O20 | C21 | H15 | 180.0° | 60.0° |
| C19 | O20 | C21 | H16 | 60.0° | 60.0° |
| C19 | O20 | C21 | H17 | 60.0° | 180.0° |
| C19 | C04 | N03 | H2 | 119.8° | 120.0° |
| C19 | C04 | N03 | C02 | 142.4° | 85.0° |
| C19 | C04 | N03 | H1 | 37.6° | 94.9° |
| C04 | C19 | H13 | H14 | 120.2° | 120.0° |
| C04 | N03 | C02 | O01 | 0.1° | 0.0° |
| C04 | N03 | C02 | H1 | 180.0° | 180.0° |
| C04 | N03 | C02 | C22 | 178.8° | 180.0° |
| N03 | C04 | C19 | H13 | 145.3° | 55.0° |
| N03 | C04 | C19 | H14 | 25.1° | 175.0° |
| O01 | C02 | N03 | C22 | 178.9° | 179.9° |
| O01 | C02 | C22 | N32 | 46.7° | 20.0° |
| O01 | C02 | C22 | C23 | 75.7° | 100.1° |
| O01 | C02 | N03 | H1 | 179.9° | 179.9° |
| O01 | C02 | C22 | H18 | 166.0° | 140.0° |
| N03 | C02 | C22 | N32 | 134.4° | 160.0° |
| N03 | C02 | C22 | C23 | 103.2° | 80.0° |
| C02 | N03 | C04 | H2 | 22.6° | 35.0° |
| N03 | C02 | C22 | H18 | 15.1° | 39.9° |
| C02 | C22 | N32 | C23 | 119.2° | 120.0° |
| C02 | C22 | N32 | H18 | 119.1° | 120.0° |
| C02 | C22 | N32 | C33 | 156.9° | 60.0° |
| C02 | C22 | C23 | H18 | 118.8° | 120.0° |
| C02 | C22 | C23 | C24 | 134.9° | 175.0° |
| C22 | C02 | N03 | H1 | 1.2° | 0.0° |
| C02 | C22 | C23 | H19 | 103.5° | 65.0° |
| C02 | C22 | C23 | H20 | 13.2° | 54.9° |
| C02 | C22 | N32 | H31 | 23.1° | 120.0° |
| C38 | C37 | C39 | O36 | 179.8° | 180.0° |
| C38 | C37 | C39 | C34 | 179.7° | 180.0° |
| C38 | C37 | O36 | N35 | 179.8° | 180.0° |
| C37 | C38 | H32 | H33 | 120.0° | 120.0° |
| C37 | C38 | H32 | H34 | 120.0° | 120.0° |
| C37 | C38 | H33 | H34 | 120.0° | 120.0° |
| C38 | C37 | C39 | H35 | 0.3° | 0.2° |
| C37 | C39 | C34 | H35 | 180.0° | 179.8° |
| C37 | C39 | C34 | C33 | 179.8° | 180.0° |
| C37 | C39 | C34 | N35 | 0.2° | 0.1° |
| C39 | C37 | O36 | N35 | 0.1° | 0.0° |
| C39 | C37 | C38 | H32 | 179.7° | 90.0° |
| C39 | C37 | C38 | H33 | 59.7° | 150.0° |
| C39 | C37 | C38 | H34 | 60.3° | 30.0° |
| C39 | C34 | C33 | N32 | 9.8° | 180.0° |
| C34 | C39 | C37 | O36 | 0.1° | 0.1° |
| C39 | C34 | C33 | N35 | 179.6° | 179.9° |
| C39 | C34 | C33 | O40 | 170.6° | 0.1° |
| C39 | C34 | N35 | O36 | 0.2° | 0.0° |
| C22 | N32 | C33 | H31 | 180.0° | 179.9° |
| N32 | C22 | C23 | H18 | 122.3° | 120.0° |
| N32 | C22 | C23 | C24 | 106.2° | 65.0° |
| C22 | N32 | C33 | C34 | 179.1° | 180.0° |
| C22 | N32 | C33 | O40 | 0.5° | 0.0° |
| N32 | C22 | C23 | H19 | 15.4° | 55.0° |
| N32 | C22 | C23 | H20 | 132.1° | 175.0° |
| C33 | N32 | C22 | C23 | 83.9° | 60.0° |
| N32 | C33 | C34 | O40 | 179.6° | 179.9° |
| N32 | C33 | C34 | N35 | 169.8° | 0.1° |
| C33 | N32 | C22 | H18 | 37.8° | 179.9° |
| C22 | C23 | C24 | H19 | 121.7° | 120.0° |
| C22 | C23 | C24 | H20 | 121.7° | 120.1° |
| C22 | C23 | C24 | N25 | 128.9° | 180.0° |
| C22 | C23 | C24 | O31 | 52.4° | 0.0° |
| C22 | C23 | H19 | H20 | 114.6° | 120.0° |
| C23 | C22 | N32 | H31 | 96.1° | 119.9° |
| C23 | C24 | N25 | O31 | 178.7° | 180.0° |
| C23 | C24 | N25 | O26 | 179.8° | 180.0° |
| C24 | C23 | C22 | H18 | 16.1° | 55.0° |
| C24 | C23 | H19 | H20 | 114.6° | 120.0° |
| C23 | C24 | N25 | H21 | 0.2° | 0.1° |
| C37 | O36 | N35 | C34 | 0.2° | 0.0° |
| O36 | C37 | C38 | H32 | 0.0° | 90.0° |
| O36 | C37 | C38 | H33 | 120.0° | 30.0° |
| O36 | C37 | C38 | H34 | 120.0° | 150.0° |
| O36 | C37 | C39 | H35 | 179.9° | 179.7° |
| C33 | C34 | N35 | O36 | 179.9° | 179.9° |
| C34 | C33 | N32 | H31 | 1.0° | 0.1° |
| C33 | C34 | C39 | H35 | 0.2° | 0.2° |
| N35 | C34 | C33 | O40 | 9.8° | 180.0° |
| N35 | C34 | C39 | H35 | 179.8° | 179.7° |
| O40 | C33 | N32 | H31 | 179.4° | 180.0° |
| C24 | N25 | O26 | H21 | 180.0° | 179.9° |
| C24 | N25 | O26 | C27 | 112.3° | 180.0° |
| N25 | C24 | C23 | H19 | 7.2° | 60.0° |
| N25 | C24 | C23 | H20 | 109.4° | 60.0° |
| O31 | C24 | N25 | O26 | 1.1° | 0.0° |
| O31 | C24 | C23 | H19 | 174.0° | 120.0° |
| O31 | C24 | C23 | H20 | 69.3° | 120.0° |
| O31 | C24 | N25 | H21 | 178.9° | 179.9° |
| C30 | C27 | O26 | N25 | 56.7° | 180.0° |
| C30 | C27 | C28 | O26 | 121.3° | 119.9° |
| C30 | C27 | C28 | C29 | 117.2° | 120.0° |
| C30 | C27 | O26 | C29 | 117.0° | 120.0° |
| C30 | C27 | C28 | H22 | 180.0° | 179.9° |
| C30 | C27 | C28 | H23 | 60.0° | 60.1° |
| C30 | C27 | C28 | H24 | 60.0° | 60.0° |
| C30 | C27 | C29 | H25 | 180.0° | 60.0° |
| C30 | C27 | C29 | H26 | 60.0° | 60.0° |
| C30 | C27 | C29 | H27 | 60.0° | 180.0° |
| C27 | C30 | H28 | H29 | 120.0° | 120.0° |
| C27 | C30 | H28 | H30 | 120.0° | 120.0° |
| C27 | C30 | H29 | H30 | 120.0° | 120.0° |
| N25 | O26 | C27 | C28 | 65.1° | 60.1° |
| N25 | O26 | C27 | C29 | 173.7° | 60.0° |
| C28 | C27 | O26 | C29 | 121.2° | 120.0° |
| C27 | C28 | H22 | H23 | 120.0° | 120.0° |
| C27 | C28 | H22 | H24 | 120.0° | 120.0° |
| C27 | C28 | H23 | H24 | 120.0° | 120.0° |
| C28 | C27 | C29 | H25 | 61.4° | 180.0° |
| C28 | C27 | C29 | H26 | 178.6° | 60.0° |
| C28 | C27 | C29 | H27 | 58.6° | 60.0° |
| C28 | C27 | C30 | H28 | 180.0° | 60.0° |
| C28 | C27 | C30 | H29 | 60.0° | 60.0° |
| C28 | C27 | C30 | H30 | 60.0° | 180.0° |
| C27 | O26 | N25 | H21 | 67.8° | 0.1° |
| O26 | C27 | C28 | H22 | 58.7° | 60.0° |
| O26 | C27 | C28 | H23 | 178.8° | 180.0° |
| O26 | C27 | C28 | H24 | 61.3° | 60.0° |
| O26 | C27 | C29 | H25 | 62.2° | 60.0° |
| O26 | C27 | C29 | H26 | 57.8° | 180.0° |
| O26 | C27 | C29 | H27 | 177.8° | 60.0° |
| O26 | C27 | C30 | H28 | 56.3° | 60.0° |
| O26 | C27 | C30 | H29 | 63.7° | 180.0° |
| O26 | C27 | C30 | H30 | 176.3° | 60.0° |
| C29 | C27 | C28 | H22 | 62.8° | 60.0° |
| C29 | C27 | C28 | H23 | 57.3° | 60.0° |
| C29 | C27 | C28 | H24 | 177.2° | 180.0° |
| C27 | C29 | H25 | H26 | 120.0° | 120.0° |
| C27 | C29 | H25 | H27 | 120.0° | 120.0° |
| C27 | C29 | H26 | H27 | 120.0° | 120.0° |
| C29 | C27 | C30 | H28 | 61.9° | 180.0° |
| C29 | C27 | C30 | H29 | 178.1° | 60.0° |
| C29 | C27 | C30 | H30 | 58.1° | 60.0° |
| H1 | N03 | C04 | H2 | 157.4° | 145.0° |
| H2 | C04 | C19 | H13 | 94.1° | 65.0° |
| H2 | C04 | C19 | H14 | 145.8° | 55.0° |
| H3 | N06 | C07 | H4 | 171.1° | 120.0° |
| H3 | N06 | C07 | H5 | 54.1° | 119.9° |
| H6 | C09 | C10 | H7 | 0.1° | 0.0° |
| H7 | C10 | C11 | H8 | 0.3° | 0.4° |
| H9 | C14 | C15 | H10 | 0.0° | 0.1° |
| H10 | C15 | C16 | H11 | 0.0° | 0.0° |
| H11 | C16 | C17 | H12 | 0.3° | 0.1° |
| H15 | C21 | H16 | H17 | 120.0° | 120.0° |
| H18 | C22 | C23 | H19 | 137.8° | 175.0° |
| H18 | C22 | C23 | H20 | 105.6° | 65.0° |
| H18 | C22 | N32 | H31 | 142.2° | 0.0° |
| H22 | C28 | H23 | H24 | 120.0° | 120.0° |
| H25 | C29 | H26 | H27 | 120.0° | 119.9° |
| H28 | C30 | H29 | H30 | 120.0° | 120.0° |
| H32 | C38 | H33 | H34 | 120.0° | 120.1° |
