A1BW1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | doub | 1.40Å | 1.39Å | Aromatic |
| C01 | C06 | sing | 1.41Å | 1.41Å | Aromatic |
| C01 | C07 | sing | 1.47Å | 1.48Å | |
| C02 | N03 | sing | 1.31Å | 1.35Å | Aromatic |
| N03 | C04 | doub | 1.33Å | 1.35Å | Aromatic |
| C04 | C05 | sing | 1.40Å | 1.39Å | Aromatic |
| C04 | C10 | sing | 1.47Å | 1.46Å | |
| C05 | C06 | doub | 1.39Å | 1.40Å | Aromatic |
| C06 | N19 | sing | 1.39Å | 1.41Å | |
| C07 | N08 | sing | 1.35Å | 1.38Å | |
| C07 | O09 | doub | 1.22Å | 1.23Å | |
| N08 | C11 | sing | 1.47Å | 1.45Å | |
| C10 | C25 | doub | 1.39Å | 1.39Å | Aromatic |
| C10 | N28 | sing | 1.37Å | 1.40Å | Aromatic |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| C12 | C13 | sing | 1.53Å | 1.54Å | |
| C12 | F17 | sing | 1.40Å | 1.37Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C13 | C15 | sing | 1.53Å | 1.53Å | |
| C13 | O16 | sing | 1.43Å | 1.43Å | |
| C18 | N19 | sing | 1.46Å | 1.43Å | |
| C18 | C20 | sing | 1.54Å | 1.55Å | |
| C18 | C22 | sing | 1.54Å | 1.55Å | |
| C20 | C21 | sing | 1.54Å | 1.55Å | |
| C21 | C22 | sing | 1.54Å | 1.55Å | |
| C21 | C23 | sing | 1.53Å | 1.52Å | |
| C23 | N24 | sing | 1.47Å | 1.45Å | |
| N24 | C35 | sing | 1.35Å | 1.38Å | |
| C25 | C26 | sing | 1.38Å | 1.41Å | Aromatic |
| C26 | C27 | doub | 1.39Å | 1.38Å | Aromatic |
| C27 | N28 | sing | 1.38Å | 1.39Å | Aromatic |
| C27 | C29 | sing | 1.40Å | 1.41Å | Aromatic |
| N28 | N32 | sing | 1.40Å | 1.37Å | Aromatic |
| C29 | C30 | doub | 1.39Å | 1.34Å | Aromatic |
| C30 | C31 | sing | 1.41Å | 1.48Å | Aromatic |
| C30 | C33 | sing | 1.43Å | 1.42Å | |
| C31 | N32 | doub | 1.30Å | 1.29Å | Aromatic |
| C33 | N34 | trip | 1.14Å | 1.16Å | |
| C35 | O36 | sing | 1.35Å | 1.37Å | |
| C35 | O37 | doub | 1.21Å | 1.23Å | |
| O36 | C38 | sing | 1.45Å | 1.43Å | |
| C15 | H12 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C26 | H25 | sing | 1.08Å | 1.08Å | |
| C02 | H1 | sing | 1.08Å | 1.08Å | |
| C05 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C14 | H9 | sing | 1.09Å | 1.10Å | |
| C14 | H7 | sing | 1.09Å | 1.10Å | |
| C14 | H8 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.08Å | 1.08Å | |
| C29 | H26 | sing | 1.08Å | 1.08Å | |
| C31 | H27 | sing | 1.08Å | 1.08Å | |
| C38 | H28 | sing | 1.09Å | 1.10Å | |
| C38 | H30 | sing | 1.09Å | 1.10Å | |
| C38 | H29 | sing | 1.09Å | 1.10Å | |
| N08 | H3 | sing | 0.97Å | 1.00Å | |
| N19 | H15 | sing | 0.97Å | 1.00Å | |
| N24 | H23 | sing | 0.97Å | 1.00Å | |
| O16 | H13 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C02 | C01 | C06 | 118.5° | 119.0° |
| C02 | C01 | C07 | 119.9° | 120.5° |
| C01 | C02 | N03 | 124.2° | 120.8° |
| C01 | C02 | H1 | 117.9° | 119.6° |
| C06 | C01 | C07 | 121.6° | 120.5° |
| C01 | C06 | C05 | 117.4° | 118.2° |
| C01 | C06 | N19 | 123.5° | 120.9° |
| C01 | C07 | N08 | 115.1° | 120.0° |
| C01 | C07 | O09 | 119.7° | 120.0° |
| C02 | N03 | C04 | 116.8° | 122.0° |
| N03 | C02 | H1 | 117.9° | 119.6° |
| N03 | C04 | C05 | 122.5° | 120.9° |
| N03 | C04 | C10 | 114.9° | 119.6° |
| C05 | C04 | C10 | 122.5° | 119.5° |
| C04 | C05 | C06 | 120.5° | 119.1° |
| C04 | C05 | H2 | 119.8° | 120.5° |
| C04 | C10 | C25 | 127.0° | 125.7° |
| C04 | C10 | N28 | 126.2° | 125.8° |
| C05 | C06 | N19 | 119.1° | 120.9° |
| C06 | C05 | H2 | 119.7° | 120.4° |
| C06 | N19 | C18 | 125.3° | 120.0° |
| C06 | N19 | H15 | 105.4° | 120.0° |
| N08 | C07 | O09 | 125.1° | 120.0° |
| C07 | N08 | C11 | 122.0° | 120.0° |
| C07 | N08 | H3 | 119.0° | 120.0° |
| N08 | C11 | C12 | 111.0° | 109.5° |
| N08 | C11 | H5 | 109.1° | 109.5° |
| N08 | C11 | H4 | 109.1° | 109.4° |
| C11 | N08 | H3 | 119.0° | 120.0° |
| C25 | C10 | N28 | 106.8° | 108.5° |
| C10 | C25 | C26 | 108.5° | 107.8° |
| C10 | C25 | H24 | 125.7° | 126.1° |
| C10 | N28 | C27 | 108.8° | 108.2° |
| C10 | N28 | N32 | 126.4° | 131.8° |
| C11 | C12 | C13 | 113.6° | 109.5° |
| C11 | C12 | F17 | 108.4° | 109.5° |
| C12 | C11 | H5 | 109.1° | 109.5° |
| C12 | C11 | H4 | 109.1° | 109.5° |
| C11 | C12 | H6 | 107.9° | 109.5° |
| C13 | C12 | F17 | 108.8° | 109.5° |
| C12 | C13 | C14 | 109.6° | 109.5° |
| C12 | C13 | C15 | 112.8° | 109.5° |
| C12 | C13 | O16 | 109.0° | 109.4° |
| C13 | C12 | H6 | 107.8° | 109.5° |
| F17 | C12 | H6 | 110.2° | 109.5° |
| C14 | C13 | C15 | 109.7° | 109.5° |
| C14 | C13 | O16 | 108.2° | 109.5° |
| C13 | C14 | H9 | 109.5° | 109.5° |
| C13 | C14 | H7 | 109.4° | 109.5° |
| C13 | C14 | H8 | 109.5° | 109.4° |
| C15 | C13 | O16 | 107.5° | 109.5° |
| C13 | C15 | H12 | 109.5° | 109.5° |
| C13 | C15 | H11 | 109.5° | 109.5° |
| C13 | C15 | H10 | 109.5° | 109.5° |
| C13 | O16 | H13 | 109.5° | 114.0° |
| N19 | C18 | C20 | 113.4° | 113.6° |
| N19 | C18 | C22 | 113.5° | 113.6° |
| N19 | C18 | H14 | 114.7° | 112.9° |
| C18 | N19 | H15 | 105.4° | 120.1° |
| C20 | C18 | C22 | 86.7° | 87.1° |
| C18 | C20 | C21 | 87.2° | 87.1° |
| C18 | C20 | H16 | 114.7° | 113.6° |
| C18 | C20 | H17 | 114.7° | 113.7° |
| C20 | C18 | H14 | 112.7° | 113.6° |
| C18 | C22 | C21 | 87.1° | 87.1° |
| C18 | C22 | H20 | 114.7° | 113.6° |
| C18 | C22 | H19 | 114.7° | 113.7° |
| C22 | C18 | H14 | 112.8° | 113.7° |
| C20 | C21 | C22 | 86.3° | 87.0° |
| C20 | C21 | C23 | 114.9° | 113.6° |
| C21 | C20 | H16 | 114.7° | 113.6° |
| C21 | C20 | H17 | 114.7° | 113.6° |
| C20 | C21 | H18 | 111.6° | 113.6° |
| C22 | C21 | C23 | 118.0° | 113.6° |
| C22 | C21 | H18 | 111.5° | 113.6° |
| C21 | C22 | H20 | 114.7° | 113.6° |
| C21 | C22 | H19 | 114.7° | 113.6° |
| C21 | C23 | N24 | 106.6° | 109.4° |
| C23 | C21 | H18 | 112.1° | 112.9° |
| C21 | C23 | H22 | 110.2° | 109.5° |
| C21 | C23 | H21 | 110.2° | 109.5° |
| C23 | N24 | C35 | 123.8° | 120.0° |
| N24 | C23 | H22 | 110.2° | 109.4° |
| N24 | C23 | H21 | 110.2° | 109.4° |
| C23 | N24 | H23 | 118.1° | 120.0° |
| N24 | C35 | O36 | 109.2° | 120.0° |
| N24 | C35 | O37 | 125.8° | 120.0° |
| C35 | N24 | H23 | 118.1° | 120.0° |
| C25 | C26 | C27 | 107.3° | 107.4° |
| C25 | C26 | H25 | 126.3° | 126.3° |
| C26 | C25 | H24 | 125.7° | 126.1° |
| C26 | C27 | N28 | 108.5° | 108.1° |
| C26 | C27 | C29 | 133.2° | 132.4° |
| C27 | C26 | H25 | 126.3° | 126.3° |
| N28 | C27 | C29 | 118.3° | 119.5° |
| C27 | N28 | N32 | 124.8° | 120.0° |
| C27 | C29 | C30 | 120.1° | 118.9° |
| C27 | C29 | H26 | 119.9° | 120.5° |
| N28 | N32 | C31 | 114.7° | 121.2° |
| C29 | C30 | C31 | 116.1° | 119.6° |
| C29 | C30 | C33 | 122.9° | 120.2° |
| C30 | C29 | H26 | 120.0° | 120.6° |
| C31 | C30 | C33 | 121.0° | 120.2° |
| C30 | C31 | N32 | 126.1° | 120.8° |
| C30 | C31 | H27 | 116.9° | 119.6° |
| C30 | C33 | N34 | 179.8° | 180.0° |
| N32 | C31 | H27 | 117.0° | 119.6° |
| O36 | C35 | O37 | 125.0° | 120.0° |
| C35 | O36 | C38 | 115.8° | 117.0° |
| O36 | C38 | H28 | 109.5° | 109.5° |
| O36 | C38 | H30 | 109.5° | 109.5° |
| O36 | C38 | H29 | 109.5° | 109.5° |
| H12 | C15 | H11 | 109.5° | 109.5° |
| H12 | C15 | H10 | 109.5° | 109.5° |
| H11 | C15 | H10 | 109.4° | 109.4° |
| H16 | C20 | H17 | 109.5° | 112.9° |
| H20 | C22 | H19 | 109.5° | 112.8° |
| H5 | C11 | H4 | 109.4° | 109.5° |
| H9 | C14 | H7 | 109.5° | 109.5° |
| H9 | C14 | H8 | 109.5° | 109.4° |
| H7 | C14 | H8 | 109.5° | 109.4° |
| H22 | C23 | H21 | 109.5° | 109.5° |
| H28 | C38 | H30 | 109.5° | 109.4° |
| H28 | C38 | H29 | 109.5° | 109.4° |
| H30 | C38 | H29 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C02 | C01 | C06 | C07 | 179.5° | 179.8° |
| C01 | C02 | N03 | H1 | 180.0° | 179.9° |
| C01 | C02 | N03 | C04 | 0.1° | 0.1° |
| C02 | C01 | C06 | C05 | 0.1° | 0.0° |
| C02 | C01 | C06 | N19 | 179.9° | 180.0° |
| C02 | C01 | C07 | N08 | 20.9° | 5.8° |
| C02 | C01 | C07 | O09 | 159.3° | 174.2° |
| C06 | C01 | C02 | N03 | 0.2° | 0.0° |
| C01 | C06 | C05 | C04 | 0.4° | 0.0° |
| C01 | C06 | C05 | N19 | 180.0° | 180.0° |
| C06 | C01 | C07 | N08 | 158.6° | 173.9° |
| C06 | C01 | C07 | O09 | 21.2° | 6.0° |
| C01 | C06 | N19 | C18 | 171.6° | 174.1° |
| C06 | C01 | C02 | H1 | 179.7° | 180.0° |
| C01 | C06 | C05 | H2 | 179.7° | 180.0° |
| C01 | C06 | N19 | H15 | 66.3° | 5.9° |
| C07 | C01 | C02 | N03 | 179.7° | 179.8° |
| C07 | C01 | C06 | C05 | 179.6° | 179.8° |
| C07 | C01 | C06 | N19 | 0.4° | 0.2° |
| C01 | C07 | N08 | O09 | 179.8° | 179.9° |
| C01 | C07 | N08 | C11 | 180.0° | 180.0° |
| C07 | C01 | C02 | H1 | 0.2° | 0.2° |
| C01 | C07 | N08 | H3 | 0.0° | 0.0° |
| C02 | N03 | C04 | C05 | 0.7° | 0.1° |
| C02 | N03 | C04 | C10 | 179.5° | 180.0° |
| N03 | C04 | C05 | C10 | 178.7° | 179.9° |
| N03 | C04 | C05 | C06 | 0.8° | 0.1° |
| N03 | C04 | C10 | C25 | 16.7° | 0.1° |
| N03 | C04 | C10 | N28 | 164.8° | 179.7° |
| C04 | N03 | C02 | H1 | 179.9° | 180.0° |
| N03 | C04 | C05 | H2 | 179.2° | 180.0° |
| C04 | C05 | C06 | H2 | 180.0° | 180.0° |
| C04 | C05 | C06 | N19 | 179.6° | 180.0° |
| C05 | C04 | C10 | C25 | 162.1° | 180.0° |
| C05 | C04 | C10 | N28 | 16.4° | 0.3° |
| C10 | C04 | C05 | C06 | 179.5° | 180.0° |
| C04 | C10 | C25 | N28 | 178.7° | 179.7° |
| C04 | C10 | C25 | C26 | 179.1° | 179.7° |
| C04 | C10 | N28 | C27 | 179.2° | 179.7° |
| C04 | C10 | N28 | N32 | 0.9° | 0.3° |
| C10 | C04 | C05 | H2 | 0.5° | 0.0° |
| C04 | C10 | C25 | H24 | 0.8° | 0.3° |
| C05 | C06 | N19 | C18 | 8.5° | 6.0° |
| C05 | C06 | N19 | H15 | 113.7° | 174.1° |
| C06 | N19 | C18 | H15 | 122.1° | 180.0° |
| C06 | N19 | C18 | C20 | 94.1° | 155.0° |
| C06 | N19 | C18 | C22 | 169.0° | 107.6° |
| N19 | C06 | C05 | H2 | 0.4° | 0.0° |
| C06 | N19 | C18 | H14 | 37.4° | 23.8° |
| C07 | N08 | C11 | H3 | 180.0° | 179.9° |
| C07 | N08 | C11 | C12 | 96.7° | 180.0° |
| C07 | N08 | C11 | H5 | 23.5° | 60.0° |
| C07 | N08 | C11 | H4 | 143.1° | 60.0° |
| O09 | C07 | N08 | C11 | 0.2° | 0.0° |
| O09 | C07 | N08 | H3 | 179.8° | 179.9° |
| N08 | C11 | C12 | H5 | 120.2° | 120.0° |
| N08 | C11 | C12 | H4 | 120.2° | 120.0° |
| N08 | C11 | C12 | C13 | 179.9° | 180.0° |
| N08 | C11 | C12 | F17 | 58.9° | 60.0° |
| N08 | C11 | H5 | H4 | 119.3° | 120.0° |
| N08 | C11 | C12 | H6 | 60.4° | 60.0° |
| C10 | C25 | C26 | H24 | 180.0° | 180.0° |
| C10 | C25 | C26 | C27 | 0.2° | 0.0° |
| C25 | C10 | N28 | C27 | 0.5° | 0.0° |
| C25 | C10 | N28 | N32 | 179.7° | 180.0° |
| C10 | C25 | C26 | H25 | 179.8° | 179.9° |
| N28 | C10 | C25 | C26 | 0.4° | 0.0° |
| C10 | N28 | C27 | C26 | 0.3° | 0.0° |
| C10 | N28 | C27 | N32 | 179.8° | 180.0° |
| C10 | N28 | C27 | C29 | 179.9° | 180.0° |
| C10 | N28 | N32 | C31 | 179.8° | 180.0° |
| N28 | C10 | C25 | H24 | 179.6° | 180.0° |
| C11 | C12 | C13 | F17 | 120.9° | 120.0° |
| C11 | C12 | C13 | H6 | 119.6° | 120.0° |
| C11 | C12 | F17 | H6 | 117.9° | 120.0° |
| C11 | C12 | C13 | C14 | 58.3° | 175.0° |
| C11 | C12 | C13 | C15 | 179.2° | 55.0° |
| C11 | C12 | C13 | O16 | 59.9° | 65.0° |
| C12 | C11 | H5 | H4 | 119.3° | 120.0° |
| C12 | C11 | N08 | H3 | 83.3° | 0.0° |
| C13 | C12 | F17 | H6 | 118.0° | 120.0° |
| C12 | C13 | C14 | C15 | 124.4° | 120.0° |
| C12 | C13 | C14 | O16 | 118.7° | 120.0° |
| C12 | C13 | C15 | O16 | 120.1° | 119.9° |
| C12 | C13 | C15 | H12 | 180.0° | 60.0° |
| C12 | C13 | C15 | H11 | 60.0° | 60.0° |
| C12 | C13 | C15 | H10 | 60.0° | 180.0° |
| C13 | C12 | C11 | H5 | 59.8° | 60.0° |
| C13 | C12 | C11 | H4 | 59.7° | 60.0° |
| C12 | C13 | C14 | H9 | 180.0° | 180.0° |
| C12 | C13 | C14 | H7 | 60.0° | 60.0° |
| C12 | C13 | C14 | H8 | 60.0° | 60.0° |
| C12 | C13 | O16 | H13 | 180.0° | 179.9° |
| F17 | C12 | C13 | C14 | 179.2° | 55.0° |
| F17 | C12 | C13 | C15 | 58.3° | 65.0° |
| F17 | C12 | C13 | O16 | 61.0° | 175.0° |
| F17 | C12 | C11 | H5 | 61.3° | 180.0° |
| F17 | C12 | C11 | H4 | 179.1° | 60.0° |
| C14 | C13 | C15 | O16 | 117.3° | 120.0° |
| C14 | C13 | C15 | H12 | 57.5° | 60.0° |
| C14 | C13 | C15 | H11 | 62.5° | 179.9° |
| C14 | C13 | C15 | H10 | 177.5° | 60.0° |
| C14 | C13 | C12 | H6 | 61.3° | 65.0° |
| C13 | C14 | H9 | H7 | 120.0° | 120.1° |
| C13 | C14 | H9 | H8 | 120.0° | 120.0° |
| C13 | C14 | H7 | H8 | 120.0° | 120.0° |
| C14 | C13 | O16 | H13 | 60.9° | 60.0° |
| C13 | C15 | H12 | H11 | 120.0° | 120.1° |
| C13 | C15 | H12 | H10 | 120.0° | 120.0° |
| C13 | C15 | H11 | H10 | 120.0° | 120.0° |
| C15 | C13 | C12 | H6 | 61.2° | 175.0° |
| C15 | C13 | C14 | H9 | 55.6° | 60.0° |
| C15 | C13 | C14 | H7 | 175.6° | 180.0° |
| C15 | C13 | C14 | H8 | 64.4° | 60.0° |
| C15 | C13 | O16 | H13 | 57.4° | 60.0° |
| O16 | C13 | C15 | H12 | 59.9° | 180.0° |
| O16 | C13 | C15 | H11 | 179.9° | 59.9° |
| O16 | C13 | C15 | H10 | 60.2° | 60.0° |
| O16 | C13 | C12 | H6 | 179.5° | 55.0° |
| O16 | C13 | C14 | H9 | 61.3° | 60.1° |
| O16 | C13 | C14 | H7 | 58.7° | 60.0° |
| O16 | C13 | C14 | H8 | 178.7° | 180.0° |
| N19 | C18 | C20 | C22 | 114.2° | 114.5° |
| N19 | C18 | C20 | H14 | 132.5° | 130.9° |
| N19 | C18 | C22 | H14 | 132.6° | 131.0° |
| N19 | C18 | C20 | C21 | 140.9° | 89.1° |
| N19 | C18 | C22 | C21 | 140.7° | 89.1° |
| N19 | C18 | C20 | H16 | 103.2° | 25.5° |
| N19 | C18 | C20 | H17 | 24.9° | 156.3° |
| N19 | C18 | C22 | H20 | 24.7° | 156.3° |
| N19 | C18 | C22 | H19 | 103.4° | 25.5° |
| C20 | C18 | C22 | H14 | 113.3° | 114.5° |
| C18 | C20 | C21 | H16 | 116.0° | 114.6° |
| C18 | C20 | C21 | H17 | 116.0° | 114.6° |
| C20 | C18 | C22 | C21 | 26.6° | 25.4° |
| C18 | C20 | C21 | C23 | 92.7° | 140.0° |
| C18 | C20 | H16 | H17 | 130.6° | 131.3° |
| C18 | C20 | C21 | H18 | 138.2° | 89.1° |
| C20 | C18 | C22 | H20 | 89.4° | 89.2° |
| C20 | C18 | C22 | H19 | 142.5° | 140.0° |
| C20 | C18 | N19 | H15 | 28.0° | 25.0° |
| C18 | C22 | C21 | H20 | 115.9° | 114.6° |
| C18 | C22 | C21 | H19 | 116.0° | 114.7° |
| C18 | C22 | C21 | C23 | 89.8° | 139.9° |
| C22 | C18 | C20 | H16 | 142.6° | 140.0° |
| C22 | C18 | C20 | H17 | 89.3° | 89.1° |
| C18 | C22 | C21 | H18 | 138.3° | 89.1° |
| C18 | C22 | H20 | H19 | 130.7° | 131.3° |
| C22 | C18 | N19 | H15 | 68.8° | 72.5° |
| C20 | C21 | C22 | C23 | 116.3° | 114.5° |
| C20 | C21 | C22 | H18 | 111.7° | 114.5° |
| C20 | C21 | C23 | H18 | 128.8° | 131.3° |
| C20 | C21 | C23 | N24 | 71.5° | 175.0° |
| C21 | C20 | H16 | H17 | 130.6° | 131.2° |
| C20 | C21 | C22 | H20 | 89.4° | 89.2° |
| C20 | C21 | C22 | H19 | 142.5° | 140.1° |
| C21 | C20 | C18 | H14 | 86.7° | 140.1° |
| C20 | C21 | C23 | H22 | 168.9° | 65.0° |
| C20 | C21 | C23 | H21 | 48.1° | 55.0° |
| C22 | C21 | C23 | H18 | 131.7° | 131.3° |
| C22 | C21 | C23 | N24 | 171.1° | 87.6° |
| C22 | C21 | C20 | H16 | 142.5° | 140.0° |
| C22 | C21 | C20 | H17 | 89.5° | 89.2° |
| C21 | C22 | H20 | H19 | 130.7° | 131.1° |
| C21 | C22 | C18 | H14 | 86.7° | 140.0° |
| C22 | C21 | C23 | H22 | 69.4° | 32.4° |
| C22 | C21 | C23 | H21 | 51.5° | 152.5° |
| C21 | C23 | N24 | H22 | 119.6° | 120.0° |
| C21 | C23 | N24 | H21 | 119.5° | 120.0° |
| C21 | C23 | N24 | C35 | 115.5° | 180.0° |
| C23 | C21 | C20 | H16 | 23.3° | 105.5° |
| C23 | C21 | C20 | H17 | 151.3° | 25.4° |
| C23 | C21 | C22 | H20 | 154.2° | 25.3° |
| C23 | C21 | C22 | H19 | 26.2° | 105.4° |
| C21 | C23 | H22 | H21 | 121.3° | 120.1° |
| C21 | C23 | N24 | H23 | 64.5° | 0.0° |
| C23 | N24 | C35 | H23 | 180.0° | 180.0° |
| C23 | N24 | C35 | O36 | 177.9° | 180.0° |
| C23 | N24 | C35 | O37 | 2.1° | 0.0° |
| N24 | C23 | C21 | H18 | 57.3° | 43.7° |
| N24 | C23 | H22 | H21 | 121.3° | 120.0° |
| N24 | C35 | O36 | O37 | 179.9° | 180.0° |
| N24 | C35 | O36 | C38 | 168.3° | 180.0° |
| C35 | N24 | C23 | H22 | 125.0° | 60.0° |
| C35 | N24 | C23 | H21 | 4.1° | 60.0° |
| C25 | C26 | C27 | H25 | 180.0° | 179.9° |
| C25 | C26 | C27 | N28 | 0.1° | 0.0° |
| C25 | C26 | C27 | C29 | 179.8° | 180.0° |
| C26 | C27 | N28 | C29 | 179.7° | 180.0° |
| C26 | C27 | N28 | N32 | 179.8° | 180.0° |
| C26 | C27 | C29 | C30 | 179.8° | 180.0° |
| C27 | C26 | C25 | H24 | 179.8° | 180.0° |
| C26 | C27 | C29 | H26 | 0.1° | 0.1° |
| N28 | C27 | C29 | C30 | 0.2° | 0.0° |
| C27 | N28 | N32 | C31 | 0.0° | 0.0° |
| N28 | C27 | C26 | H25 | 179.9° | 179.9° |
| N28 | C27 | C29 | H26 | 179.8° | 179.9° |
| C29 | C27 | N28 | N32 | 0.1° | 0.0° |
| C27 | C29 | C30 | H26 | 180.0° | 179.9° |
| C27 | C29 | C30 | C31 | 0.2° | 0.1° |
| C27 | C29 | C30 | C33 | 179.9° | 180.0° |
| C29 | C27 | C26 | H25 | 0.2° | 0.1° |
| N28 | N32 | C31 | C30 | 0.0° | 0.1° |
| N28 | N32 | C31 | H27 | 180.0° | 180.0° |
| C29 | C30 | C31 | C33 | 179.9° | 179.9° |
| C29 | C30 | C31 | N32 | 0.1° | 0.1° |
| C29 | C30 | C33 | N34 | 7.4° | 78.3° |
| C29 | C30 | C31 | H27 | 179.9° | 180.0° |
| C30 | C31 | N32 | H27 | 180.0° | 179.9° |
| C31 | C30 | C33 | N34 | 172.7° | 101.7° |
| C31 | C30 | C29 | H26 | 179.8° | 179.9° |
| C33 | C30 | C31 | N32 | 180.0° | 180.0° |
| C33 | C30 | C29 | H26 | 0.1° | 0.1° |
| C33 | C30 | C31 | H27 | 0.0° | 0.1° |
| C35 | O36 | C38 | H28 | 180.0° | 60.0° |
| C35 | O36 | C38 | H30 | 60.0° | 180.0° |
| C35 | O36 | C38 | H29 | 60.0° | 60.0° |
| O36 | C35 | N24 | H23 | 2.1° | 0.0° |
| O37 | C35 | O36 | C38 | 11.7° | 0.0° |
| O37 | C35 | N24 | H23 | 178.0° | 180.0° |
| O36 | C38 | H28 | H30 | 120.0° | 120.0° |
| O36 | C38 | H28 | H29 | 120.0° | 120.0° |
| O36 | C38 | H30 | H29 | 120.0° | 120.1° |
| H12 | C15 | H11 | H10 | 120.0° | 120.0° |
| H16 | C20 | C21 | H18 | 105.8° | 25.5° |
| H16 | C20 | C18 | H14 | 29.3° | 105.4° |
| H17 | C20 | C21 | H18 | 22.2° | 156.3° |
| H17 | C20 | C18 | H14 | 157.3° | 25.5° |
| H18 | C21 | C22 | H20 | 22.3° | 156.3° |
| H18 | C21 | C22 | H19 | 105.8° | 25.6° |
| H18 | C21 | C23 | H22 | 62.3° | 163.7° |
| H18 | C21 | C23 | H21 | 176.8° | 76.2° |
| H20 | C22 | C18 | H14 | 157.3° | 25.4° |
| H19 | C22 | C18 | H14 | 29.2° | 105.5° |
| H25 | C26 | C25 | H24 | 0.2° | 0.1° |
| H5 | C11 | C12 | H6 | 179.3° | 60.0° |
| H5 | C11 | N08 | H3 | 156.5° | 119.9° |
| H4 | C11 | C12 | H6 | 59.8° | 180.0° |
| H4 | C11 | N08 | H3 | 36.9° | 120.0° |
| H9 | C14 | H7 | H8 | 120.0° | 120.0° |
| H14 | C18 | N19 | H15 | 159.5° | 156.2° |
| H22 | C23 | N24 | H23 | 55.1° | 120.0° |
| H21 | C23 | N24 | H23 | 176.0° | 120.0° |
| H28 | C38 | H30 | H29 | 120.0° | 119.9° |
