A1L6R
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C36 | C35 | sing | 1.51Å | 1.50Å | |
| C35 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C35 | N37 | sing | 1.32Å | 1.34Å | Aromatic |
| C34 | C33 | sing | 1.39Å | 1.38Å | Aromatic |
| N37 | C31 | doub | 1.33Å | 1.34Å | Aromatic |
| C33 | C32 | doub | 1.38Å | 1.38Å | Aromatic |
| C31 | C32 | sing | 1.40Å | 1.39Å | Aromatic |
| C31 | C30 | sing | 1.48Å | 1.47Å | |
| N29 | C30 | doub | 1.31Å | 1.31Å | Aromatic |
| N29 | N28 | sing | 1.28Å | 1.39Å | Aromatic |
| C01 | O02 | sing | 1.43Å | 1.42Å | |
| C30 | N11 | sing | 1.38Å | 1.37Å | Aromatic |
| N28 | C12 | doub | 1.32Å | 1.34Å | Aromatic |
| O02 | C03 | sing | 1.36Å | 1.36Å | |
| N11 | C12 | sing | 1.37Å | 1.37Å | Aromatic |
| N11 | C10 | sing | 1.40Å | 1.44Å | |
| C12 | N13 | sing | 1.38Å | 1.36Å | |
| C03 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C03 | C04 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | C07 | sing | 1.39Å | 1.40Å | Aromatic |
| C04 | C05 | doub | 1.38Å | 1.38Å | Aromatic |
| O16 | S14 | doub | 1.42Å | 1.43Å | |
| N13 | S14 | sing | 1.66Å | 1.63Å | |
| C07 | O08 | sing | 1.36Å | 1.36Å | |
| C07 | C06 | doub | 1.39Å | 1.39Å | Aromatic |
| O08 | C09 | sing | 1.43Å | 1.42Å | |
| C05 | C06 | sing | 1.38Å | 1.38Å | Aromatic |
| S14 | C17 | sing | 1.81Å | 1.80Å | |
| S14 | O15 | doub | 1.42Å | 1.43Å | |
| O20 | C19 | sing | 1.43Å | 1.42Å | |
| N27 | C26 | doub | 1.32Å | 1.35Å | Aromatic |
| N27 | C21 | sing | 1.32Å | 1.34Å | Aromatic |
| C17 | C19 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.53Å | 1.53Å | |
| C26 | C24 | sing | 1.39Å | 1.38Å | Aromatic |
| C19 | C21 | sing | 1.51Å | 1.51Å | |
| C21 | N22 | doub | 1.32Å | 1.34Å | Aromatic |
| C24 | C25 | sing | 1.51Å | 1.51Å | |
| C24 | C23 | doub | 1.39Å | 1.38Å | Aromatic |
| N22 | C23 | sing | 1.32Å | 1.34Å | Aromatic |
| C17 | H1 | sing | 1.09Å | 1.10Å | |
| C18 | H2 | sing | 1.09Å | 1.10Å | |
| C18 | H3 | sing | 1.09Å | 1.10Å | |
| C18 | H4 | sing | 1.09Å | 1.10Å | |
| C19 | H5 | sing | 1.09Å | 1.10Å | |
| C23 | H6 | sing | 1.08Å | 1.08Å | |
| C25 | H7 | sing | 1.09Å | 1.10Å | |
| C25 | H8 | sing | 1.09Å | 1.10Å | |
| C25 | H9 | sing | 1.09Å | 1.10Å | |
| C26 | H10 | sing | 1.08Å | 1.08Å | |
| C32 | H11 | sing | 1.08Å | 1.08Å | |
| C01 | H12 | sing | 1.09Å | 1.10Å | |
| C01 | H13 | sing | 1.09Å | 1.10Å | |
| C01 | H14 | sing | 1.09Å | 1.10Å | |
| C04 | H15 | sing | 1.08Å | 1.08Å | |
| C05 | H16 | sing | 1.08Å | 1.08Å | |
| C06 | H17 | sing | 1.08Å | 1.08Å | |
| C09 | H18 | sing | 1.09Å | 1.10Å | |
| C09 | H19 | sing | 1.09Å | 1.10Å | |
| C09 | H20 | sing | 1.09Å | 1.10Å | |
| C33 | H21 | sing | 1.08Å | 1.08Å | |
| C34 | H22 | sing | 1.08Å | 1.08Å | |
| C36 | H23 | sing | 1.09Å | 1.10Å | |
| C36 | H24 | sing | 1.09Å | 1.10Å | |
| C36 | H25 | sing | 1.09Å | 1.10Å | |
| N13 | H26 | sing | 0.97Å | 1.00Å | |
| O20 | H27 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C36 | C35 | C34 | 121.9° | 119.6° |
| C36 | C35 | N37 | 116.2° | 119.6° |
| C35 | C36 | H23 | 109.5° | 109.5° |
| C35 | C36 | H24 | 109.5° | 109.5° |
| C35 | C36 | H25 | 109.4° | 109.5° |
| C34 | C35 | N37 | 121.9° | 120.9° |
| C35 | C34 | C33 | 119.1° | 119.4° |
| C35 | C34 | H22 | 120.4° | 120.3° |
| C35 | N37 | C31 | 118.7° | 121.6° |
| C34 | C33 | C32 | 119.1° | 118.5° |
| C34 | C33 | H21 | 120.4° | 120.7° |
| C33 | C34 | H22 | 120.4° | 120.2° |
| N37 | C31 | C32 | 122.2° | 120.5° |
| N37 | C31 | C30 | 117.1° | 119.7° |
| C33 | C32 | C31 | 119.0° | 119.1° |
| C33 | C32 | H11 | 120.5° | 120.5° |
| C32 | C33 | H21 | 120.4° | 120.8° |
| C32 | C31 | C30 | 120.8° | 119.7° |
| C31 | C32 | H11 | 120.5° | 120.5° |
| C31 | C30 | N29 | 122.8° | 126.5° |
| C31 | C30 | N11 | 127.8° | 126.4° |
| C30 | N29 | N28 | 108.5° | 110.0° |
| N29 | C30 | N11 | 109.3° | 107.1° |
| N29 | N28 | C12 | 107.2° | 110.1° |
| C01 | O02 | C03 | 117.8° | 117.0° |
| O02 | C01 | H12 | 109.5° | 109.5° |
| O02 | C01 | H13 | 109.5° | 109.5° |
| O02 | C01 | H14 | 109.5° | 109.4° |
| C30 | N11 | C12 | 106.4° | 105.6° |
| C30 | N11 | C10 | 129.9° | 127.2° |
| N28 | C12 | N11 | 108.5° | 107.3° |
| N28 | C12 | N13 | 126.8° | 126.3° |
| O02 | C03 | C10 | 116.1° | 120.1° |
| O02 | C03 | C04 | 123.8° | 120.1° |
| C12 | N11 | C10 | 123.8° | 127.2° |
| N11 | C12 | N13 | 124.7° | 126.4° |
| N11 | C10 | C03 | 120.1° | 120.1° |
| N11 | C10 | C07 | 120.5° | 120.1° |
| C12 | N13 | S14 | 125.1° | 120.0° |
| C12 | N13 | H26 | 105.5° | 120.0° |
| C10 | C03 | C04 | 120.1° | 119.9° |
| C03 | C10 | C07 | 119.5° | 119.8° |
| C03 | C04 | C05 | 119.7° | 120.1° |
| C03 | C04 | H15 | 120.1° | 120.0° |
| C10 | C07 | O08 | 116.7° | 120.0° |
| C10 | C07 | C06 | 119.9° | 119.9° |
| C04 | C05 | C06 | 121.1° | 120.2° |
| C05 | C04 | H15 | 120.2° | 119.9° |
| C04 | C05 | H16 | 119.4° | 119.9° |
| O16 | S14 | N13 | 108.6° | 104.3° |
| O16 | S14 | C17 | 108.9° | 110.6° |
| O16 | S14 | O15 | 119.5° | 121.1° |
| N13 | S14 | C17 | 104.3° | 104.4° |
| N13 | S14 | O15 | 107.5° | 104.3° |
| S14 | N13 | H26 | 105.5° | 120.0° |
| O08 | C07 | C06 | 123.4° | 120.1° |
| C07 | O08 | C09 | 117.7° | 117.0° |
| C07 | C06 | C05 | 119.7° | 120.1° |
| C07 | C06 | H17 | 120.2° | 119.9° |
| O08 | C09 | H18 | 109.5° | 109.4° |
| O08 | C09 | H19 | 109.5° | 109.4° |
| O08 | C09 | H20 | 109.5° | 109.5° |
| C06 | C05 | H16 | 119.4° | 119.9° |
| C05 | C06 | H17 | 120.1° | 120.0° |
| C17 | S14 | O15 | 107.1° | 110.5° |
| S14 | C17 | C19 | 111.0° | 109.4° |
| S14 | C17 | C18 | 108.6° | 109.5° |
| S14 | C17 | H1 | 105.7° | 109.5° |
| O20 | C19 | C17 | 110.6° | 109.5° |
| O20 | C19 | C21 | 108.3° | 109.5° |
| O20 | C19 | H5 | 110.8° | 109.4° |
| C19 | O20 | H27 | 109.5° | 114.0° |
| C26 | N27 | C21 | 116.9° | 120.8° |
| N27 | C26 | C24 | 122.5° | 119.1° |
| N27 | C26 | H10 | 118.8° | 120.4° |
| N27 | C21 | C19 | 117.0° | 119.1° |
| N27 | C21 | N22 | 125.1° | 121.8° |
| C19 | C17 | C18 | 113.9° | 109.5° |
| C17 | C19 | C21 | 108.5° | 109.5° |
| C19 | C17 | H1 | 108.6° | 109.5° |
| C17 | C19 | H5 | 109.2° | 109.5° |
| C18 | C17 | H1 | 108.7° | 109.5° |
| C17 | C18 | H2 | 109.5° | 109.5° |
| C17 | C18 | H3 | 109.5° | 109.4° |
| C17 | C18 | H4 | 109.5° | 109.5° |
| C26 | C24 | C25 | 122.0° | 120.8° |
| C26 | C24 | C23 | 116.1° | 118.4° |
| C24 | C26 | H10 | 118.7° | 120.5° |
| C19 | C21 | N22 | 117.9° | 119.2° |
| C21 | C19 | H5 | 109.5° | 109.4° |
| C21 | N22 | C23 | 116.9° | 120.8° |
| C25 | C24 | C23 | 121.9° | 120.8° |
| C24 | C25 | H7 | 109.5° | 109.5° |
| C24 | C25 | H8 | 109.5° | 109.5° |
| C24 | C25 | H9 | 109.5° | 109.5° |
| C24 | C23 | N22 | 122.5° | 119.1° |
| C24 | C23 | H6 | 118.7° | 120.5° |
| N22 | C23 | H6 | 118.7° | 120.4° |
| H2 | C18 | H3 | 109.5° | 109.4° |
| H2 | C18 | H4 | 109.5° | 109.5° |
| H3 | C18 | H4 | 109.5° | 109.5° |
| H7 | C25 | H8 | 109.5° | 109.4° |
| H7 | C25 | H9 | 109.5° | 109.5° |
| H8 | C25 | H9 | 109.5° | 109.4° |
| H12 | C01 | H13 | 109.4° | 109.5° |
| H12 | C01 | H14 | 109.5° | 109.4° |
| H13 | C01 | H14 | 109.5° | 109.5° |
| H18 | C09 | H19 | 109.5° | 109.5° |
| H18 | C09 | H20 | 109.5° | 109.5° |
| H19 | C09 | H20 | 109.4° | 109.5° |
| H23 | C36 | H24 | 109.4° | 109.5° |
| H23 | C36 | H25 | 109.5° | 109.4° |
| H24 | C36 | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C36 | C35 | C34 | N37 | 179.9° | 179.7° |
| C36 | C35 | C34 | C33 | 179.8° | 179.9° |
| C36 | C35 | N37 | C31 | 179.6° | 179.8° |
| C36 | C35 | C34 | H22 | 0.2° | 0.0° |
| C35 | C36 | H23 | H24 | 120.0° | 120.0° |
| C35 | C36 | H23 | H25 | 120.0° | 120.0° |
| C35 | C36 | H24 | H25 | 120.0° | 120.0° |
| C35 | C34 | C33 | H22 | 180.0° | 180.0° |
| C34 | C35 | N37 | C31 | 0.3° | 0.5° |
| C35 | C34 | C33 | C32 | 0.4° | 0.0° |
| C35 | C34 | C33 | H21 | 179.6° | 180.0° |
| C34 | C35 | C36 | H23 | 180.0° | 90.0° |
| C34 | C35 | C36 | H24 | 60.0° | 150.0° |
| C34 | C35 | C36 | H25 | 59.9° | 30.0° |
| N37 | C35 | C34 | C33 | 0.3° | 0.2° |
| C35 | N37 | C31 | C32 | 0.8° | 0.4° |
| C35 | N37 | C31 | C30 | 179.5° | 179.7° |
| N37 | C35 | C34 | H22 | 179.7° | 179.7° |
| N37 | C35 | C36 | H23 | 0.0° | 89.8° |
| N37 | C35 | C36 | H24 | 120.0° | 30.3° |
| N37 | C35 | C36 | H25 | 120.0° | 150.3° |
| C34 | C33 | C32 | H21 | 180.0° | 179.9° |
| C34 | C33 | C32 | C31 | 0.1° | 0.1° |
| C34 | C33 | C32 | H11 | 179.9° | 180.0° |
| N37 | C31 | C32 | C33 | 0.7° | 0.1° |
| N37 | C31 | C32 | C30 | 178.7° | 179.8° |
| N37 | C31 | C30 | N29 | 4.0° | 179.6° |
| N37 | C31 | C30 | N11 | 176.7° | 0.2° |
| N37 | C31 | C32 | H11 | 179.3° | 179.8° |
| C33 | C32 | C31 | H11 | 180.0° | 179.9° |
| C33 | C32 | C31 | C30 | 179.4° | 180.0° |
| C32 | C33 | C34 | H22 | 179.6° | 180.0° |
| C32 | C31 | C30 | N29 | 174.7° | 0.2° |
| C32 | C31 | C30 | N11 | 4.5° | 180.0° |
| C31 | C32 | C33 | H21 | 179.9° | 180.0° |
| C31 | C30 | N29 | N11 | 179.4° | 179.8° |
| C31 | C30 | N29 | N28 | 179.4° | 179.8° |
| C31 | C30 | N11 | C12 | 179.6° | 180.0° |
| C31 | C30 | N11 | C10 | 0.8° | 0.1° |
| C30 | C31 | C32 | H11 | 0.6° | 0.0° |
| C30 | N29 | N28 | C12 | 0.2° | 0.2° |
| N29 | C30 | N11 | C12 | 0.3° | 0.2° |
| N29 | C30 | N11 | C10 | 179.9° | 179.9° |
| N28 | N29 | C30 | N11 | 0.0° | 0.0° |
| N29 | N28 | C12 | N11 | 0.4° | 0.3° |
| N29 | N28 | C12 | N13 | 179.2° | 180.0° |
| C01 | O02 | C03 | C10 | 131.3° | 180.0° |
| C01 | O02 | C03 | C04 | 49.4° | 0.0° |
| O02 | C01 | H12 | H13 | 120.0° | 120.1° |
| O02 | C01 | H12 | H14 | 120.0° | 120.0° |
| O02 | C01 | H13 | H14 | 120.0° | 120.0° |
| C30 | N11 | C12 | N28 | 0.5° | 0.3° |
| C30 | N11 | C12 | C10 | 179.6° | 179.9° |
| C30 | N11 | C12 | N13 | 179.3° | 180.0° |
| C30 | N11 | C10 | C03 | 88.3° | 89.7° |
| C30 | N11 | C10 | C07 | 91.1° | 90.0° |
| N28 | C12 | N11 | N13 | 178.8° | 179.7° |
| N28 | C12 | N11 | C10 | 179.9° | 179.8° |
| N28 | C12 | N13 | S14 | 19.7° | 15.3° |
| N28 | C12 | N13 | H26 | 141.8° | 164.7° |
| O02 | C03 | C10 | N11 | 0.8° | 0.3° |
| O02 | C03 | C10 | C04 | 179.3° | 180.0° |
| O02 | C03 | C10 | C07 | 179.9° | 179.9° |
| O02 | C03 | C04 | C05 | 179.7° | 180.0° |
| C03 | O02 | C01 | H12 | 180.0° | 60.0° |
| C03 | O02 | C01 | H13 | 60.0° | 180.0° |
| C03 | O02 | C01 | H14 | 60.0° | 60.0° |
| O02 | C03 | C04 | H15 | 0.3° | 0.1° |
| C12 | N11 | C10 | C03 | 92.2° | 90.2° |
| C12 | N11 | C10 | C07 | 88.5° | 90.0° |
| N11 | C12 | N13 | S14 | 161.7° | 165.0° |
| N11 | C12 | N13 | H26 | 39.6° | 15.0° |
| C10 | N11 | C12 | N13 | 1.1° | 0.1° |
| N11 | C10 | C03 | C07 | 179.3° | 179.8° |
| N11 | C10 | C03 | C04 | 179.9° | 179.7° |
| N11 | C10 | C07 | O08 | 0.3° | 0.2° |
| N11 | C10 | C07 | C06 | 179.7° | 179.8° |
| C12 | N13 | S14 | O16 | 36.3° | 178.9° |
| C12 | N13 | S14 | H26 | 122.1° | 180.0° |
| C12 | N13 | S14 | C17 | 79.7° | 65.0° |
| C12 | N13 | S14 | O15 | 166.8° | 51.0° |
| C10 | C03 | C04 | C05 | 0.4° | 0.0° |
| C03 | C10 | C07 | O08 | 179.6° | 180.0° |
| C03 | C10 | C07 | C06 | 0.3° | 0.0° |
| C10 | C03 | C04 | H15 | 179.6° | 180.0° |
| C04 | C03 | C10 | C07 | 0.5° | 0.0° |
| C03 | C04 | C05 | H15 | 180.0° | 180.0° |
| C03 | C04 | C05 | C06 | 0.1° | 0.1° |
| C03 | C04 | C05 | H16 | 179.9° | 179.9° |
| C10 | C07 | O08 | C06 | 180.0° | 180.0° |
| C10 | C07 | O08 | C09 | 177.9° | 180.0° |
| C10 | C07 | C06 | C05 | 0.0° | 0.1° |
| C10 | C07 | C06 | H17 | 180.0° | 180.0° |
| C04 | C05 | C06 | C07 | 0.1° | 0.1° |
| C04 | C05 | C06 | H16 | 180.0° | 179.9° |
| C04 | C05 | C06 | H17 | 179.9° | 179.9° |
| O16 | S14 | N13 | C17 | 116.0° | 116.1° |
| O16 | S14 | N13 | O15 | 130.5° | 127.9° |
| O16 | S14 | C17 | O15 | 130.5° | 136.8° |
| O16 | S14 | C17 | C19 | 54.0° | 68.3° |
| O16 | S14 | C17 | C18 | 180.0° | 51.6° |
| O16 | S14 | C17 | H1 | 63.6° | 171.6° |
| O16 | S14 | N13 | H26 | 158.4° | 1.0° |
| N13 | S14 | C17 | O15 | 113.8° | 111.6° |
| N13 | S14 | C17 | C19 | 169.7° | 180.0° |
| N13 | S14 | C17 | C18 | 64.2° | 60.0° |
| N13 | S14 | C17 | H1 | 52.2° | 60.0° |
| O08 | C07 | C06 | C05 | 180.0° | 179.9° |
| O08 | C07 | C06 | H17 | 0.0° | 0.1° |
| C07 | O08 | C09 | H18 | 180.0° | 180.0° |
| C07 | O08 | C09 | H19 | 60.0° | 60.0° |
| C07 | O08 | C09 | H20 | 60.0° | 60.0° |
| C06 | C07 | O08 | C09 | 2.1° | 0.0° |
| C07 | C06 | C05 | H17 | 180.0° | 180.0° |
| C07 | C06 | C05 | H16 | 179.9° | 180.0° |
| O08 | C09 | H18 | H19 | 120.0° | 119.9° |
| O08 | C09 | H18 | H20 | 120.0° | 120.0° |
| O08 | C09 | H19 | H20 | 120.0° | 120.0° |
| C06 | C05 | C04 | H15 | 179.9° | 180.0° |
| S14 | C17 | C19 | O20 | 45.1° | 60.0° |
| S14 | C17 | C19 | C18 | 123.0° | 120.0° |
| S14 | C17 | C19 | H1 | 115.8° | 120.0° |
| S14 | C17 | C18 | H1 | 114.5° | 120.0° |
| S14 | C17 | C19 | C21 | 163.7° | 60.1° |
| S14 | C17 | C18 | H2 | 180.0° | 60.0° |
| S14 | C17 | C18 | H3 | 60.0° | 179.9° |
| S14 | C17 | C18 | H4 | 60.0° | 60.0° |
| S14 | C17 | C19 | H5 | 77.1° | 180.0° |
| C17 | S14 | N13 | H26 | 42.5° | 115.0° |
| O15 | S14 | C17 | C19 | 76.5° | 68.4° |
| O15 | S14 | C17 | C18 | 49.5° | 171.6° |
| O15 | S14 | C17 | H1 | 166.0° | 51.6° |
| O15 | S14 | N13 | H26 | 71.0° | 128.9° |
| O20 | C19 | C21 | N27 | 26.0° | 44.8° |
| O20 | C19 | C17 | C21 | 118.6° | 120.1° |
| O20 | C19 | C17 | H5 | 122.1° | 120.0° |
| O20 | C19 | C17 | C18 | 168.1° | 59.9° |
| O20 | C19 | C21 | H5 | 120.9° | 119.9° |
| O20 | C19 | C21 | N22 | 154.5° | 134.9° |
| O20 | C19 | C17 | H1 | 70.7° | 180.0° |
| N27 | C26 | C24 | H10 | 180.0° | 180.0° |
| C26 | N27 | C21 | C19 | 179.6° | 180.0° |
| C26 | N27 | C21 | N22 | 0.2° | 0.3° |
| N27 | C26 | C24 | C25 | 179.8° | 180.0° |
| N27 | C26 | C24 | C23 | 0.4° | 0.3° |
| N27 | C21 | C19 | C17 | 94.0° | 75.3° |
| C21 | N27 | C26 | C24 | 0.3° | 0.0° |
| N27 | C21 | C19 | N22 | 179.5° | 179.7° |
| N27 | C21 | N22 | C23 | 0.1° | 0.3° |
| N27 | C21 | C19 | H5 | 146.9° | 164.7° |
| C21 | N27 | C26 | H10 | 179.7° | 180.0° |
| C19 | C17 | C18 | H1 | 121.2° | 120.1° |
| C17 | C19 | C21 | H5 | 119.1° | 120.0° |
| C17 | C19 | C21 | N22 | 85.4° | 104.9° |
| C19 | C17 | C18 | H2 | 55.7° | 59.9° |
| C19 | C17 | C18 | H3 | 175.7° | 60.0° |
| C19 | C17 | C18 | H4 | 64.3° | 180.0° |
| C17 | C19 | O20 | H27 | 21.4° | 60.0° |
| C18 | C17 | C19 | C21 | 73.3° | 180.0° |
| C17 | C18 | H2 | H3 | 120.0° | 119.9° |
| C17 | C18 | H2 | H4 | 120.0° | 120.0° |
| C17 | C18 | H3 | H4 | 120.0° | 120.0° |
| C18 | C17 | C19 | H5 | 45.9° | 60.0° |
| C26 | C24 | C25 | C23 | 179.4° | 179.7° |
| C26 | C24 | C23 | N22 | 0.3° | 0.3° |
| C26 | C24 | C23 | H6 | 179.8° | 179.7° |
| C26 | C24 | C25 | H7 | 90.3° | 89.7° |
| C26 | C24 | C25 | H8 | 149.7° | 30.3° |
| C26 | C24 | C25 | H9 | 29.7° | 150.2° |
| C19 | C21 | N22 | C23 | 179.5° | 180.0° |
| C21 | C19 | C17 | H1 | 47.9° | 59.9° |
| C21 | C19 | O20 | H27 | 140.1° | 60.1° |
| C21 | N22 | C23 | C24 | 0.1° | 0.0° |
| N22 | C21 | C19 | H5 | 33.6° | 15.0° |
| C21 | N22 | C23 | H6 | 179.9° | 179.9° |
| C25 | C24 | C23 | N22 | 179.7° | 180.0° |
| C25 | C24 | C23 | H6 | 0.3° | 0.0° |
| C24 | C25 | H7 | H8 | 120.0° | 120.0° |
| C24 | C25 | H7 | H9 | 120.0° | 120.1° |
| C24 | C25 | H8 | H9 | 120.0° | 120.0° |
| C25 | C24 | C26 | H10 | 0.2° | 0.1° |
| C24 | C23 | N22 | H6 | 180.0° | 180.0° |
| C23 | C24 | C25 | H7 | 90.3° | 90.0° |
| C23 | C24 | C25 | H8 | 29.7° | 150.0° |
| C23 | C24 | C25 | H9 | 149.7° | 30.1° |
| C23 | C24 | C26 | H10 | 179.6° | 179.8° |
| H1 | C17 | C18 | H2 | 65.5° | 180.0° |
| H1 | C17 | C18 | H3 | 54.5° | 60.1° |
| H1 | C17 | C18 | H4 | 174.5° | 60.0° |
| H1 | C17 | C19 | H5 | 167.2° | 60.0° |
| H2 | C18 | H3 | H4 | 120.0° | 120.0° |
| H5 | C19 | O20 | H27 | 99.9° | 180.0° |
| H7 | C25 | H8 | H9 | 120.0° | 120.0° |
| H11 | C32 | C33 | H21 | 0.1° | 0.1° |
| H12 | C01 | H13 | H14 | 120.0° | 119.9° |
| H15 | C04 | C05 | H16 | 0.0° | 0.1° |
| H16 | C05 | C06 | H17 | 0.1° | 0.0° |
| H18 | C09 | H19 | H20 | 120.0° | 120.0° |
| H21 | C33 | C34 | H22 | 0.4° | 0.1° |
| H23 | C36 | H24 | H25 | 120.0° | 120.0° |
