6XO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C6 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
| C6 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | C2 | doub | 1.38Å | 1.40Å | Aromatic |
| C4 | C7 | sing | 1.51Å | 1.52Å | |
| C4 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C2 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | O8 | sing | 1.45Å | 1.44Å | |
| O8 | C9 | sing | 1.35Å | 1.32Å | |
| C9 | O18 | doub | 1.21Å | 1.21Å | |
| C9 | N10 | sing | 1.35Å | 1.34Å | |
| N10 | C11 | sing | 1.47Å | 1.45Å | |
| C11 | P12 | sing | 1.82Å | 1.82Å | |
| O20 | P12 | doub | 1.48Å | 1.52Å | |
| O19 | P12 | sing | 1.61Å | 1.49Å | |
| P12 | N13 | sing | 1.68Å | 1.57Å | |
| O34 | C33 | doub | 1.21Å | 1.22Å | |
| O35 | C33 | sing | 1.34Å | 1.32Å | |
| C33 | C17 | sing | 1.51Å | 1.49Å | |
| N13 | C14 | sing | 1.47Å | 1.48Å | |
| C17 | N16 | sing | 1.47Å | 1.45Å | |
| C17 | C26 | sing | 1.53Å | 1.56Å | |
| N16 | C15 | sing | 1.35Å | 1.34Å | |
| C15 | O25 | doub | 1.21Å | 1.22Å | |
| C15 | C14 | sing | 1.51Å | 1.50Å | |
| C14 | C21 | sing | 1.53Å | 1.55Å | |
| C28 | C29 | sing | 1.53Å | 1.54Å | |
| C28 | C27 | sing | 1.53Å | 1.53Å | |
| C29 | C30 | sing | 1.53Å | 1.54Å | |
| C26 | C27 | sing | 1.53Å | 1.53Å | |
| C27 | C32 | sing | 1.53Å | 1.54Å | |
| C21 | C22 | sing | 1.53Å | 1.53Å | |
| C30 | C31 | sing | 1.53Å | 1.54Å | |
| C23 | C22 | sing | 1.53Å | 1.53Å | |
| C22 | C24 | sing | 1.53Å | 1.53Å | |
| C32 | C31 | sing | 1.53Å | 1.54Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C11 | H7 | sing | 1.09Å | 1.10Å | |
| C14 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C22 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.09Å | 1.10Å | |
| C24 | H14 | sing | 1.09Å | 1.10Å | |
| C27 | H15 | sing | 1.09Å | 1.10Å | |
| C30 | H16 | sing | 1.09Å | 1.10Å | |
| C30 | H17 | sing | 1.09Å | 1.10Å | |
| C31 | H18 | sing | 1.09Å | 1.10Å | |
| C31 | H19 | sing | 1.09Å | 1.10Å | |
| C32 | H20 | sing | 1.09Å | 1.10Å | |
| C32 | H21 | sing | 1.09Å | 1.10Å | |
| O19 | H22 | sing | 0.97Å | 0.95Å | |
| N13 | H23 | sing | 1.01Å | 1.00Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| N16 | H27 | sing | 0.97Å | 1.00Å | |
| C17 | H28 | sing | 1.09Å | 1.10Å | |
| O35 | H29 | sing | 0.97Å | 0.95Å | |
| C26 | H30 | sing | 1.09Å | 1.10Å | |
| C26 | H31 | sing | 1.09Å | 1.10Å | |
| C29 | H32 | sing | 1.09Å | 1.10Å | |
| C29 | H33 | sing | 1.09Å | 1.10Å | |
| C28 | H34 | sing | 1.09Å | 1.10Å | |
| C28 | H35 | sing | 1.09Å | 1.10Å | |
| C5 | H36 | sing | 1.08Å | 1.08Å | |
| C6 | H37 | sing | 1.08Å | 1.08Å | |
| N10 | H38 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C6 | C1 | 121.0° | 120.0° |
| C6 | C5 | C4 | 119.6° | 120.0° |
| C6 | C5 | H36 | 120.2° | 120.0° |
| C5 | C6 | H37 | 119.5° | 120.0° |
| C6 | C1 | C2 | 118.9° | 120.0° |
| C6 | C1 | H1 | 120.6° | 120.0° |
| C1 | C6 | H37 | 119.5° | 120.0° |
| C5 | C4 | C7 | 120.4° | 120.0° |
| C5 | C4 | C3 | 119.9° | 120.0° |
| C4 | C5 | H36 | 120.2° | 120.0° |
| C1 | C2 | C3 | 120.2° | 120.0° |
| C2 | C1 | H1 | 120.6° | 120.1° |
| C1 | C2 | H2 | 119.9° | 119.9° |
| C7 | C4 | C3 | 119.7° | 120.0° |
| C4 | C7 | O8 | 99.7° | 109.4° |
| C4 | C7 | H4 | 111.8° | 109.5° |
| C4 | C7 | H5 | 111.8° | 109.5° |
| C4 | C3 | C2 | 120.6° | 120.0° |
| C4 | C3 | H3 | 119.7° | 120.0° |
| C3 | C2 | H2 | 119.9° | 120.0° |
| C2 | C3 | H3 | 119.7° | 120.0° |
| C7 | O8 | C9 | 113.4° | 117.0° |
| O8 | C7 | H4 | 111.9° | 109.5° |
| O8 | C7 | H5 | 111.8° | 109.5° |
| O8 | C9 | O18 | 123.1° | 120.0° |
| O8 | C9 | N10 | 110.7° | 120.0° |
| O18 | C9 | N10 | 126.1° | 120.0° |
| C9 | N10 | C11 | 118.0° | 120.0° |
| C9 | N10 | H38 | 121.0° | 120.0° |
| N10 | C11 | P12 | 111.2° | 109.5° |
| N10 | C11 | H6 | 109.1° | 109.5° |
| N10 | C11 | H7 | 109.0° | 109.5° |
| C11 | N10 | H38 | 121.0° | 120.0° |
| C11 | P12 | O20 | 109.5° | 109.5° |
| C11 | P12 | O19 | 109.6° | 109.5° |
| C11 | P12 | N13 | 103.0° | 109.5° |
| P12 | C11 | H6 | 109.0° | 109.5° |
| P12 | C11 | H7 | 109.1° | 109.4° |
| O20 | P12 | O19 | 112.7° | 109.5° |
| O20 | P12 | N13 | 109.4° | 109.5° |
| O19 | P12 | N13 | 112.3° | 109.5° |
| P12 | O19 | H22 | 109.5° | 113.9° |
| P12 | N13 | C14 | 121.2° | 111.0° |
| P12 | N13 | H23 | 106.4° | 111.0° |
| O34 | C33 | O35 | 122.1° | 120.0° |
| O34 | C33 | C17 | 121.7° | 120.0° |
| O35 | C33 | C17 | 116.2° | 120.0° |
| C33 | O35 | H29 | 109.5° | 117.0° |
| C33 | C17 | N16 | 112.2° | 109.4° |
| C33 | C17 | C26 | 112.2° | 109.5° |
| C33 | C17 | H28 | 109.3° | 109.5° |
| N13 | C14 | C15 | 113.1° | 109.5° |
| N13 | C14 | C21 | 107.2° | 109.4° |
| N13 | C14 | H8 | 110.1° | 109.5° |
| C14 | N13 | H23 | 106.5° | 111.0° |
| N16 | C17 | C26 | 104.5° | 109.5° |
| C17 | N16 | C15 | 122.3° | 120.0° |
| C17 | N16 | H27 | 118.9° | 120.0° |
| N16 | C17 | H28 | 109.8° | 109.5° |
| C17 | C26 | C27 | 118.5° | 109.5° |
| C26 | C17 | H28 | 108.5° | 109.5° |
| C17 | C26 | H30 | 107.2° | 109.5° |
| C17 | C26 | H31 | 107.2° | 109.5° |
| N16 | C15 | O25 | 123.9° | 120.0° |
| N16 | C15 | C14 | 114.9° | 120.0° |
| C15 | N16 | H27 | 118.9° | 120.0° |
| O25 | C15 | C14 | 121.1° | 120.0° |
| C15 | C14 | C21 | 107.4° | 109.5° |
| C15 | C14 | H8 | 109.8° | 109.5° |
| C14 | C21 | C22 | 114.7° | 109.5° |
| C21 | C14 | H8 | 109.1° | 109.4° |
| C14 | C21 | H9 | 108.1° | 109.5° |
| C14 | C21 | H10 | 108.1° | 109.4° |
| C29 | C28 | C27 | 109.7° | 109.5° |
| C28 | C29 | C30 | 110.6° | 109.4° |
| C28 | C29 | H32 | 109.2° | 109.5° |
| C28 | C29 | H33 | 109.2° | 109.4° |
| C29 | C28 | H34 | 109.4° | 109.5° |
| C29 | C28 | H35 | 109.4° | 109.5° |
| C28 | C27 | C26 | 108.3° | 109.5° |
| C28 | C27 | C32 | 108.3° | 109.4° |
| C28 | C27 | H15 | 110.7° | 109.5° |
| C27 | C28 | H34 | 109.4° | 109.5° |
| C27 | C28 | H35 | 109.4° | 109.5° |
| C29 | C30 | C31 | 110.7° | 109.5° |
| C29 | C30 | H16 | 109.1° | 109.4° |
| C29 | C30 | H17 | 109.2° | 109.5° |
| C30 | C29 | H32 | 109.2° | 109.5° |
| C30 | C29 | H33 | 109.2° | 109.5° |
| C26 | C27 | C32 | 108.0° | 109.5° |
| C26 | C27 | H15 | 110.8° | 109.5° |
| C27 | C26 | H30 | 107.2° | 109.5° |
| C27 | C26 | H31 | 107.2° | 109.4° |
| C27 | C32 | C31 | 110.5° | 109.5° |
| C32 | C27 | H15 | 110.6° | 109.5° |
| C27 | C32 | H20 | 109.2° | 109.5° |
| C27 | C32 | H21 | 109.2° | 109.5° |
| C21 | C22 | C23 | 109.7° | 109.5° |
| C21 | C22 | C24 | 110.8° | 109.4° |
| C22 | C21 | H9 | 108.1° | 109.5° |
| C22 | C21 | H10 | 108.1° | 109.5° |
| C21 | C22 | H11 | 108.7° | 109.5° |
| C30 | C31 | C32 | 107.1° | 109.4° |
| C31 | C30 | H16 | 109.2° | 109.5° |
| C31 | C30 | H17 | 109.1° | 109.5° |
| C30 | C31 | H18 | 110.1° | 109.4° |
| C30 | C31 | H19 | 110.1° | 109.5° |
| C23 | C22 | C24 | 110.2° | 109.5° |
| C23 | C22 | H11 | 108.7° | 109.5° |
| C22 | C23 | H24 | 109.5° | 109.5° |
| C22 | C23 | H25 | 109.5° | 109.5° |
| C22 | C23 | H26 | 109.5° | 109.5° |
| C24 | C22 | H11 | 108.7° | 109.5° |
| C22 | C24 | H12 | 109.5° | 109.5° |
| C22 | C24 | H13 | 109.5° | 109.5° |
| C22 | C24 | H14 | 109.5° | 109.5° |
| C32 | C31 | H18 | 110.1° | 109.5° |
| C32 | C31 | H19 | 110.1° | 109.5° |
| C31 | C32 | H20 | 109.2° | 109.4° |
| C31 | C32 | H21 | 109.2° | 109.5° |
| H4 | C7 | H5 | 109.5° | 109.5° |
| H6 | C11 | H7 | 109.5° | 109.5° |
| H9 | C21 | H10 | 109.5° | 109.5° |
| H12 | C24 | H13 | 109.5° | 109.5° |
| H12 | C24 | H14 | 109.4° | 109.5° |
| H13 | C24 | H14 | 109.5° | 109.4° |
| H16 | C30 | H17 | 109.5° | 109.4° |
| H18 | C31 | H19 | 109.5° | 109.5° |
| H20 | C32 | H21 | 109.5° | 109.4° |
| H24 | C23 | H25 | 109.4° | 109.5° |
| H24 | C23 | H26 | 109.5° | 109.5° |
| H25 | C23 | H26 | 109.5° | 109.4° |
| H30 | C26 | H31 | 109.5° | 109.5° |
| H32 | C29 | H33 | 109.5° | 109.4° |
| H34 | C28 | H35 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C6 | C1 | H37 | 180.0° | 179.6° |
| C6 | C5 | C4 | H36 | 180.0° | 179.7° |
| C5 | C6 | C1 | C2 | 0.5° | 0.5° |
| C6 | C5 | C4 | C7 | 179.9° | 179.8° |
| C6 | C5 | C4 | C3 | 1.5° | 0.2° |
| C5 | C6 | C1 | H1 | 179.5° | 179.8° |
| C1 | C6 | C5 | C4 | 0.8° | 0.5° |
| C6 | C1 | C2 | H1 | 180.0° | 179.7° |
| C6 | C1 | C2 | C3 | 1.2° | 0.3° |
| C6 | C1 | C2 | H2 | 178.7° | 179.8° |
| C1 | C6 | C5 | H36 | 179.1° | 179.8° |
| C5 | C4 | C7 | C3 | 178.6° | 180.0° |
| C5 | C4 | C3 | C2 | 0.7° | 0.0° |
| C5 | C4 | C7 | O8 | 100.9° | 90.0° |
| C5 | C4 | C3 | H3 | 179.3° | 180.0° |
| C5 | C4 | C7 | H4 | 140.7° | 29.9° |
| C5 | C4 | C7 | H5 | 17.5° | 150.0° |
| C4 | C5 | C6 | H37 | 179.2° | 180.0° |
| C1 | C2 | C3 | C4 | 0.6° | 0.0° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | H3 | 179.3° | 179.9° |
| C2 | C1 | C6 | H37 | 179.5° | 179.9° |
| C7 | C4 | C3 | C2 | 179.4° | 180.0° |
| C4 | C7 | O8 | H4 | 118.4° | 119.9° |
| C4 | C7 | O8 | H5 | 118.4° | 120.0° |
| C4 | C7 | O8 | C9 | 146.7° | 180.0° |
| C7 | C4 | C3 | H3 | 0.7° | 0.0° |
| C4 | C7 | H4 | H5 | 124.5° | 120.0° |
| C7 | C4 | C5 | H36 | 0.1° | 0.1° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C3 | C4 | C7 | O8 | 80.5° | 90.0° |
| C4 | C3 | C2 | H2 | 179.3° | 180.0° |
| C3 | C4 | C7 | H4 | 37.9° | 150.0° |
| C3 | C4 | C7 | H5 | 161.1° | 30.0° |
| C3 | C4 | C5 | H36 | 178.5° | 180.0° |
| C3 | C2 | C1 | H1 | 178.8° | 180.0° |
| C7 | O8 | C9 | O18 | 19.5° | 0.0° |
| C7 | O8 | C9 | N10 | 160.7° | 180.0° |
| O8 | C7 | H4 | H5 | 124.6° | 120.0° |
| O8 | C9 | O18 | N10 | 179.8° | 180.0° |
| O8 | C9 | N10 | C11 | 178.8° | 180.0° |
| C9 | O8 | C7 | H4 | 28.4° | 60.0° |
| C9 | O8 | C7 | H5 | 94.9° | 60.0° |
| O8 | C9 | N10 | H38 | 1.3° | 0.0° |
| O18 | C9 | N10 | C11 | 1.1° | 0.0° |
| O18 | C9 | N10 | H38 | 178.9° | 180.0° |
| C9 | N10 | C11 | H38 | 180.0° | 180.0° |
| C9 | N10 | C11 | P12 | 150.7° | 95.0° |
| C9 | N10 | C11 | H6 | 89.0° | 25.0° |
| C9 | N10 | C11 | H7 | 30.5° | 145.0° |
| N10 | C11 | P12 | H6 | 120.3° | 120.0° |
| N10 | C11 | P12 | H7 | 120.2° | 120.0° |
| N10 | C11 | P12 | O20 | 85.8° | 60.0° |
| N10 | C11 | P12 | O19 | 38.2° | 60.0° |
| N10 | C11 | P12 | N13 | 157.9° | 180.0° |
| N10 | C11 | H6 | H7 | 119.2° | 120.0° |
| C11 | P12 | O20 | O19 | 122.2° | 120.0° |
| C11 | P12 | O20 | N13 | 112.1° | 120.0° |
| C11 | P12 | O19 | N13 | 113.8° | 120.0° |
| C11 | P12 | N13 | C14 | 135.0° | 175.2° |
| P12 | C11 | H6 | H7 | 119.2° | 120.0° |
| C11 | P12 | O19 | H22 | 122.2° | 64.9° |
| C11 | P12 | N13 | H23 | 103.3° | 51.2° |
| P12 | C11 | N10 | H38 | 29.3° | 85.0° |
| O20 | P12 | O19 | N13 | 124.0° | 120.0° |
| O20 | P12 | N13 | C14 | 18.6° | 64.8° |
| O20 | P12 | C11 | H6 | 153.9° | 60.0° |
| O20 | P12 | C11 | H7 | 34.4° | 180.0° |
| O20 | P12 | O19 | H22 | 0.0° | 175.1° |
| O20 | P12 | N13 | H23 | 140.3° | 171.2° |
| O19 | P12 | N13 | C14 | 107.2° | 55.2° |
| O19 | P12 | C11 | H6 | 82.1° | 180.0° |
| O19 | P12 | C11 | H7 | 158.5° | 60.0° |
| O19 | P12 | N13 | H23 | 14.4° | 68.8° |
| P12 | N13 | C14 | H23 | 121.6° | 124.0° |
| P12 | N13 | C14 | C15 | 84.3° | 145.6° |
| P12 | N13 | C14 | C21 | 157.5° | 94.4° |
| N13 | P12 | C11 | H6 | 37.6° | 60.0° |
| N13 | P12 | C11 | H7 | 81.9° | 60.0° |
| P12 | N13 | C14 | H8 | 38.9° | 25.5° |
| N13 | P12 | O19 | H22 | 124.0° | 55.1° |
| O34 | C33 | O35 | C17 | 179.0° | 179.9° |
| O34 | C33 | C17 | N16 | 147.9° | 0.1° |
| O34 | C33 | C17 | C26 | 94.8° | 119.9° |
| O34 | C33 | C17 | H28 | 25.7° | 120.0° |
| O34 | C33 | O35 | H29 | 0.0° | 0.1° |
| O35 | C33 | C17 | N16 | 31.1° | 180.0° |
| O35 | C33 | C17 | C26 | 86.3° | 60.0° |
| O35 | C33 | C17 | H28 | 153.3° | 60.1° |
| C33 | C17 | N16 | C26 | 121.9° | 120.0° |
| C33 | C17 | N16 | H28 | 121.9° | 120.0° |
| C33 | C17 | C26 | H28 | 120.9° | 120.0° |
| C33 | C17 | N16 | C15 | 122.9° | 85.0° |
| C33 | C17 | C26 | C27 | 59.2° | 175.0° |
| C33 | C17 | N16 | H27 | 57.1° | 95.0° |
| C17 | C33 | O35 | H29 | 179.0° | 180.0° |
| C33 | C17 | C26 | H30 | 179.5° | 55.0° |
| C33 | C17 | C26 | H31 | 62.1° | 65.0° |
| N13 | C14 | C15 | N16 | 34.6° | 172.8° |
| N13 | C14 | C15 | O25 | 148.0° | 7.1° |
| N13 | C14 | C15 | C21 | 118.1° | 120.0° |
| N13 | C14 | C15 | H8 | 123.4° | 120.0° |
| N13 | C14 | C21 | H8 | 119.2° | 120.0° |
| N13 | C14 | C21 | C22 | 179.3° | 173.1° |
| N13 | C14 | C21 | H9 | 58.6° | 53.1° |
| N13 | C14 | C21 | H10 | 59.9° | 66.9° |
| N16 | C17 | C26 | H28 | 117.2° | 120.0° |
| C17 | N16 | C15 | H27 | 180.0° | 180.0° |
| C17 | N16 | C15 | O25 | 2.9° | 3.7° |
| C17 | N16 | C15 | C14 | 174.4° | 176.3° |
| N16 | C17 | C26 | C27 | 178.9° | 65.0° |
| N16 | C17 | C26 | H30 | 57.6° | 175.0° |
| N16 | C17 | C26 | H31 | 59.8° | 55.0° |
| C26 | C17 | N16 | C15 | 115.2° | 155.0° |
| C17 | C26 | C27 | C28 | 86.0° | 65.0° |
| C17 | C26 | C27 | H30 | 121.3° | 120.0° |
| C17 | C26 | C27 | H31 | 121.3° | 120.0° |
| C17 | C26 | C27 | C32 | 156.9° | 175.0° |
| C17 | C26 | C27 | H15 | 35.6° | 55.0° |
| C26 | C17 | N16 | H27 | 64.8° | 25.0° |
| C17 | C26 | H30 | H31 | 115.9° | 120.0° |
| N16 | C15 | O25 | C14 | 177.1° | 179.9° |
| N16 | C15 | C14 | C21 | 83.4° | 67.2° |
| N16 | C15 | C14 | H8 | 158.0° | 52.8° |
| C15 | N16 | C17 | H28 | 1.0° | 35.0° |
| O25 | C15 | C14 | C21 | 93.9° | 112.9° |
| O25 | C15 | C14 | H8 | 24.6° | 127.2° |
| O25 | C15 | N16 | H27 | 177.1° | 176.2° |
| C15 | C14 | C21 | H8 | 118.9° | 120.0° |
| C15 | C14 | C21 | C22 | 58.8° | 66.8° |
| C15 | C14 | C21 | H9 | 179.6° | 173.1° |
| C15 | C14 | C21 | H10 | 61.9° | 53.1° |
| C15 | C14 | N13 | H23 | 154.1° | 90.4° |
| C14 | C15 | N16 | H27 | 5.6° | 3.7° |
| C14 | C21 | C22 | H9 | 120.8° | 120.0° |
| C14 | C21 | C22 | H10 | 120.8° | 119.9° |
| C14 | C21 | C22 | C23 | 72.8° | 173.3° |
| C14 | C21 | C22 | C24 | 165.3° | 66.7° |
| C14 | C21 | H9 | H10 | 117.6° | 120.0° |
| C14 | C21 | C22 | H11 | 45.9° | 53.3° |
| C21 | C14 | N13 | H23 | 35.9° | 29.6° |
| C29 | C28 | C27 | H34 | 120.0° | 120.1° |
| C29 | C28 | C27 | H35 | 120.1° | 120.0° |
| C28 | C29 | C30 | H32 | 120.2° | 120.0° |
| C28 | C29 | C30 | H33 | 120.2° | 120.0° |
| C29 | C28 | C27 | C26 | 176.1° | 180.0° |
| C29 | C28 | C27 | C32 | 59.3° | 60.0° |
| C28 | C29 | C30 | C31 | 57.9° | 60.0° |
| C29 | C28 | C27 | H15 | 62.2° | 60.0° |
| C28 | C29 | C30 | H16 | 62.3° | 180.0° |
| C28 | C29 | C30 | H17 | 178.1° | 60.0° |
| C28 | C29 | H32 | H33 | 119.5° | 120.0° |
| C29 | C28 | H34 | H35 | 119.9° | 120.0° |
| C27 | C28 | C29 | C30 | 57.3° | 60.1° |
| C28 | C27 | C26 | C32 | 117.1° | 119.9° |
| C28 | C27 | C26 | H15 | 121.6° | 120.0° |
| C28 | C27 | C32 | H15 | 121.5° | 120.0° |
| C28 | C27 | C32 | C31 | 63.4° | 60.0° |
| C28 | C27 | C32 | H20 | 176.5° | 180.0° |
| C28 | C27 | C32 | H21 | 56.8° | 60.0° |
| C28 | C27 | C26 | H30 | 152.7° | 55.0° |
| C28 | C27 | C26 | H31 | 35.3° | 175.0° |
| C27 | C28 | C29 | H32 | 177.5° | 60.0° |
| C27 | C28 | C29 | H33 | 62.9° | 180.0° |
| C27 | C28 | H34 | H35 | 119.9° | 120.0° |
| C29 | C30 | C31 | H16 | 120.2° | 120.0° |
| C29 | C30 | C31 | H17 | 120.2° | 120.1° |
| C29 | C30 | C31 | C32 | 59.3° | 60.0° |
| C29 | C30 | H16 | H17 | 119.5° | 120.0° |
| C29 | C30 | C31 | H18 | 178.9° | 180.0° |
| C29 | C30 | C31 | H19 | 60.3° | 60.0° |
| C30 | C29 | H32 | H33 | 119.5° | 120.0° |
| C30 | C29 | C28 | H34 | 177.3° | 60.0° |
| C30 | C29 | C28 | H35 | 62.7° | 180.0° |
| C26 | C27 | C32 | H15 | 121.4° | 120.0° |
| C26 | C27 | C32 | C31 | 179.6° | 180.0° |
| C26 | C27 | C32 | H20 | 59.4° | 60.0° |
| C26 | C27 | C32 | H21 | 60.3° | 60.0° |
| C27 | C26 | C17 | H28 | 61.7° | 55.0° |
| C27 | C26 | H30 | H31 | 115.9° | 120.0° |
| C26 | C27 | C28 | H34 | 63.8° | 59.9° |
| C26 | C27 | C28 | H35 | 56.1° | 60.0° |
| C27 | C32 | C31 | C30 | 62.6° | 60.0° |
| C27 | C32 | C31 | H20 | 120.1° | 120.0° |
| C27 | C32 | C31 | H21 | 120.1° | 120.1° |
| C27 | C32 | C31 | H18 | 177.7° | 180.0° |
| C27 | C32 | C31 | H19 | 57.0° | 59.9° |
| C27 | C32 | H20 | H21 | 119.6° | 120.0° |
| C32 | C27 | C26 | H30 | 35.7° | 65.0° |
| C32 | C27 | C26 | H31 | 81.8° | 55.0° |
| C32 | C27 | C28 | H34 | 179.3° | 60.0° |
| C32 | C27 | C28 | H35 | 60.8° | 179.9° |
| C21 | C22 | C23 | C24 | 122.3° | 120.0° |
| C21 | C22 | C23 | H11 | 118.7° | 120.0° |
| C21 | C22 | C24 | H11 | 119.4° | 120.0° |
| C22 | C21 | C14 | H8 | 60.1° | 53.2° |
| C22 | C21 | H9 | H10 | 117.6° | 120.0° |
| C21 | C22 | C24 | H12 | 180.0° | 64.5° |
| C21 | C22 | C24 | H13 | 60.0° | 175.5° |
| C21 | C22 | C24 | H14 | 60.0° | 55.5° |
| C21 | C22 | C23 | H24 | 180.0° | 60.0° |
| C21 | C22 | C23 | H25 | 60.0° | 180.0° |
| C21 | C22 | C23 | H26 | 60.0° | 60.0° |
| C30 | C31 | C32 | H18 | 119.7° | 119.9° |
| C30 | C31 | C32 | H19 | 119.6° | 120.0° |
| C31 | C30 | H16 | H17 | 119.4° | 120.0° |
| C30 | C31 | H18 | H19 | 121.1° | 120.0° |
| C30 | C31 | C32 | H20 | 177.2° | 180.0° |
| C30 | C31 | C32 | H21 | 57.5° | 60.0° |
| C31 | C30 | C29 | H32 | 178.1° | 60.0° |
| C31 | C30 | C29 | H33 | 62.3° | 180.0° |
| C23 | C22 | C24 | H11 | 119.0° | 120.0° |
| C23 | C22 | C21 | H9 | 48.0° | 66.6° |
| C23 | C22 | C21 | H10 | 166.5° | 53.4° |
| C23 | C22 | C24 | H12 | 58.4° | 55.4° |
| C23 | C22 | C24 | H13 | 61.7° | 64.6° |
| C23 | C22 | C24 | H14 | 178.4° | 175.5° |
| C22 | C23 | H24 | H25 | 120.0° | 120.0° |
| C22 | C23 | H24 | H26 | 120.0° | 120.0° |
| C22 | C23 | H25 | H26 | 120.0° | 120.0° |
| C24 | C22 | C21 | H9 | 73.9° | 53.4° |
| C24 | C22 | C21 | H10 | 44.5° | 173.4° |
| C22 | C24 | H12 | H13 | 120.0° | 120.0° |
| C22 | C24 | H12 | H14 | 120.0° | 120.0° |
| C22 | C24 | H13 | H14 | 120.0° | 120.0° |
| C24 | C22 | C23 | H24 | 57.7° | 180.0° |
| C24 | C22 | C23 | H25 | 177.7° | 60.0° |
| C24 | C22 | C23 | H26 | 62.3° | 60.0° |
| C31 | C32 | C27 | H15 | 58.1° | 60.0° |
| C32 | C31 | C30 | H16 | 60.9° | 180.0° |
| C32 | C31 | C30 | H17 | 179.5° | 60.0° |
| C32 | C31 | H18 | H19 | 121.1° | 120.0° |
| C31 | C32 | H20 | H21 | 119.5° | 120.0° |
| H1 | C1 | C2 | H2 | 1.3° | 0.0° |
| H1 | C1 | C6 | H37 | 0.5° | 0.2° |
| H2 | C2 | C3 | H3 | 0.7° | 0.0° |
| H6 | C11 | N10 | H38 | 91.0° | 155.0° |
| H7 | C11 | N10 | H38 | 149.6° | 35.0° |
| H8 | C14 | C21 | H9 | 60.6° | 66.9° |
| H8 | C14 | C21 | H10 | 179.1° | 173.1° |
| H8 | C14 | N13 | H23 | 82.7° | 149.5° |
| H9 | C21 | C22 | H11 | 166.7° | 173.4° |
| H10 | C21 | C22 | H11 | 74.9° | 66.6° |
| H11 | C22 | C24 | H12 | 60.6° | 175.5° |
| H11 | C22 | C24 | H13 | 179.4° | 55.5° |
| H11 | C22 | C24 | H14 | 59.4° | 64.5° |
| H11 | C22 | C23 | H24 | 61.3° | 60.0° |
| H11 | C22 | C23 | H25 | 58.7° | 60.0° |
| H11 | C22 | C23 | H26 | 178.7° | NaN° |
| H12 | C24 | H13 | H14 | 120.0° | 120.0° |
| H15 | C27 | C32 | H20 | 62.0° | 60.0° |
| H15 | C27 | C32 | H21 | 178.3° | 180.0° |
| H15 | C27 | C26 | H30 | 85.6° | 175.0° |
| H15 | C27 | C26 | H31 | 156.9° | 65.0° |
| H15 | C27 | C28 | H34 | 57.8° | 180.0° |
| H15 | C27 | C28 | H35 | 177.8° | 60.0° |
| H16 | C30 | C31 | H18 | 58.8° | 60.0° |
| H16 | C30 | C31 | H19 | 179.5° | 60.0° |
| H16 | C30 | C29 | H32 | 57.9° | 60.0° |
| H16 | C30 | C29 | H33 | 177.6° | 60.0° |
| H17 | C30 | C31 | H18 | 60.9° | 59.9° |
| H17 | C30 | C31 | H19 | 59.8° | 180.0° |
| H17 | C30 | C29 | H32 | 61.8° | 180.0° |
| H17 | C30 | C29 | H33 | 57.9° | 59.9° |
| H18 | C31 | C32 | H20 | 57.6° | 60.0° |
| H18 | C31 | C32 | H21 | 62.1° | 59.9° |
| H19 | C31 | C32 | H20 | 63.2° | 60.0° |
| H19 | C31 | C32 | H21 | 177.1° | NaN° |
| H24 | C23 | H25 | H26 | 120.0° | 120.0° |
| H27 | N16 | C17 | H28 | 179.0° | 145.0° |
| H28 | C17 | C26 | H30 | 59.5° | 65.0° |
| H28 | C17 | C26 | H31 | 177.0° | 175.0° |
| H32 | C29 | C28 | H34 | 62.5° | 180.0° |
| H32 | C29 | C28 | H35 | 57.4° | 60.0° |
| H33 | C29 | C28 | H34 | 57.1° | 60.0° |
| H33 | C29 | C28 | H35 | 177.1° | 60.0° |
| H36 | C5 | C6 | H37 | 0.9° | 0.2° |
