6PK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C35 | C36 | doub | 1.38Å | 1.44Å | Aromatic |
| C35 | C34 | sing | 1.38Å | 1.44Å | Aromatic |
| C36 | C37 | sing | 1.38Å | 1.45Å | Aromatic |
| C34 | C33 | doub | 1.38Å | 1.45Å | Aromatic |
| C37 | C38 | doub | 1.38Å | 1.44Å | Aromatic |
| C33 | C38 | sing | 1.38Å | 1.44Å | Aromatic |
| C33 | C32 | sing | 1.51Å | 1.54Å | |
| N15 | C16 | sing | 1.47Å | 1.48Å | |
| N15 | C13 | sing | 1.35Å | 1.41Å | |
| C30 | O31 | sing | 1.43Å | 1.45Å | |
| C30 | C12 | sing | 1.53Å | 1.55Å | |
| C16 | C17 | sing | 1.51Å | 1.53Å | |
| C32 | O31 | sing | 1.43Å | 1.45Å | |
| C12 | C13 | sing | 1.51Å | 1.50Å | |
| C12 | N11 | sing | 1.47Å | 1.49Å | |
| C13 | O14 | doub | 1.21Å | 1.23Å | |
| C17 | N19 | sing | 1.35Å | 1.35Å | |
| C17 | O18 | doub | 1.21Å | 1.23Å | |
| N19 | C20 | sing | 1.47Å | 1.49Å | |
| N11 | S8 | sing | 1.66Å | 1.65Å | |
| O10 | S8 | doub | 1.42Å | 1.45Å | |
| C20 | C21 | sing | 1.51Å | 1.56Å | |
| S8 | C7 | sing | 1.81Å | 1.82Å | |
| S8 | O9 | doub | 1.42Å | 1.45Å | |
| C7 | C4 | sing | 1.51Å | 1.54Å | |
| C5 | C4 | doub | 1.38Å | 1.44Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.44Å | Aromatic |
| C21 | C26 | doub | 1.38Å | 1.46Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.44Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.45Å | Aromatic |
| C6 | C1 | doub | 1.38Å | 1.45Å | Aromatic |
| C26 | C25 | sing | 1.38Å | 1.44Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.44Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.45Å | Aromatic |
| C25 | C24 | doub | 1.39Å | 1.44Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.45Å | Aromatic |
| C23 | C24 | sing | 1.40Å | 1.45Å | Aromatic |
| C24 | C27 | sing | 1.48Å | 1.51Å | |
| C27 | N28 | doub | 1.30Å | 1.29Å | |
| C27 | N29 | sing | 1.38Å | 1.33Å | |
| 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 | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C16 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C22 | H11 | sing | 1.08Å | 1.08Å | |
| N29 | H12 | sing | 0.97Å | 1.00Å | |
| N29 | H13 | sing | 0.97Å | 1.00Å | |
| C30 | H14 | sing | 1.09Å | 1.10Å | |
| C30 | H15 | sing | 1.09Å | 1.10Å | |
| C32 | H16 | sing | 1.09Å | 1.10Å | |
| C32 | H17 | sing | 1.09Å | 1.10Å | |
| C34 | H18 | sing | 1.08Å | 1.08Å | |
| C35 | H19 | sing | 1.08Å | 1.08Å | |
| N11 | H20 | sing | 0.97Å | 1.00Å | |
| C38 | H21 | sing | 1.08Å | 1.08Å | |
| C37 | H22 | sing | 1.08Å | 1.08Å | |
| C36 | H23 | sing | 1.08Å | 1.08Å | |
| N15 | H24 | sing | 0.97Å | 1.00Å | |
| N19 | H25 | sing | 0.97Å | 1.00Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C25 | H27 | sing | 1.08Å | 1.08Å | |
| N28 | H28 | sing | 0.97Å | 1.00Å | |
| C23 | H29 | sing | 1.08Å | 1.08Å | |
| C5 | H30 | sing | 1.08Å | 1.08Å | |
| C6 | H31 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C36 | C35 | C34 | 119.5° | 120.0° |
| C35 | C36 | C37 | 120.4° | 120.0° |
| C36 | C35 | H19 | 120.3° | 120.0° |
| C35 | C36 | H23 | 119.8° | 120.0° |
| C35 | C34 | C33 | 120.6° | 120.0° |
| C35 | C34 | H18 | 119.7° | 120.0° |
| C34 | C35 | H19 | 120.3° | 120.0° |
| C36 | C37 | C38 | 120.1° | 120.0° |
| C36 | C37 | H22 | 120.0° | 119.9° |
| C37 | C36 | H23 | 119.8° | 120.0° |
| C34 | C33 | C38 | 119.7° | 120.0° |
| C34 | C33 | C32 | 118.0° | 120.0° |
| C33 | C34 | H18 | 119.7° | 120.0° |
| C37 | C38 | C33 | 119.8° | 120.0° |
| C37 | C38 | H21 | 120.1° | 120.0° |
| C38 | C37 | H22 | 120.0° | 120.0° |
| C38 | C33 | C32 | 122.3° | 120.0° |
| C33 | C38 | H21 | 120.1° | 120.0° |
| C33 | C32 | O31 | 117.0° | 109.5° |
| C33 | C32 | H16 | 107.6° | 109.5° |
| C33 | C32 | H17 | 107.6° | 109.5° |
| C16 | N15 | C13 | 116.3° | 120.0° |
| N15 | C16 | C17 | 107.4° | 109.4° |
| N15 | C16 | H7 | 110.0° | 109.5° |
| N15 | C16 | H8 | 110.0° | 109.5° |
| C16 | N15 | H24 | 121.8° | 120.0° |
| N15 | C13 | C12 | 120.8° | 120.0° |
| N15 | C13 | O14 | 123.1° | 120.0° |
| C13 | N15 | H24 | 121.9° | 120.0° |
| O31 | C30 | C12 | 108.8° | 109.5° |
| C30 | O31 | C32 | 114.0° | 114.0° |
| O31 | C30 | H14 | 109.6° | 109.5° |
| O31 | C30 | H15 | 109.6° | 109.5° |
| C30 | C12 | C13 | 115.0° | 109.5° |
| C30 | C12 | N11 | 105.6° | 109.5° |
| C30 | C12 | H6 | 109.1° | 109.5° |
| C12 | C30 | H14 | 109.7° | 109.4° |
| C12 | C30 | H15 | 109.6° | 109.4° |
| C16 | C17 | N19 | 121.5° | 120.0° |
| C16 | C17 | O18 | 117.3° | 120.0° |
| C17 | C16 | H7 | 110.0° | 109.5° |
| C17 | C16 | H8 | 110.0° | 109.4° |
| O31 | C32 | H16 | 107.6° | 109.5° |
| O31 | C32 | H17 | 107.6° | 109.5° |
| C13 | C12 | N11 | 107.3° | 109.5° |
| C12 | C13 | O14 | 116.1° | 120.0° |
| C13 | C12 | H6 | 109.7° | 109.4° |
| C12 | N11 | S8 | 125.3° | 120.0° |
| N11 | C12 | H6 | 109.9° | 109.5° |
| C12 | N11 | H20 | 105.3° | 120.0° |
| N19 | C17 | O18 | 121.2° | 120.0° |
| C17 | N19 | C20 | 118.2° | 120.0° |
| C17 | N19 | H25 | 120.9° | 120.0° |
| N19 | C20 | C21 | 109.3° | 109.4° |
| N19 | C20 | H9 | 109.5° | 109.4° |
| N19 | C20 | H10 | 109.5° | 109.4° |
| C20 | N19 | H25 | 120.9° | 120.0° |
| N11 | S8 | O10 | 107.2° | 104.3° |
| N11 | S8 | C7 | 104.0° | 104.4° |
| N11 | S8 | O9 | 108.6° | 104.3° |
| S8 | N11 | H20 | 105.4° | 120.0° |
| O10 | S8 | C7 | 108.9° | 110.5° |
| O10 | S8 | O9 | 120.3° | 121.0° |
| C20 | C21 | C26 | 122.1° | 119.8° |
| C20 | C21 | C22 | 119.2° | 119.9° |
| C21 | C20 | H9 | 109.5° | 109.5° |
| C21 | C20 | H10 | 109.5° | 109.5° |
| C7 | S8 | O9 | 106.7° | 110.5° |
| S8 | C7 | C4 | 114.4° | 109.5° |
| S8 | C7 | H4 | 108.2° | 109.5° |
| S8 | C7 | H5 | 108.2° | 109.5° |
| C7 | C4 | C5 | 120.1° | 120.0° |
| C7 | C4 | C3 | 120.5° | 120.0° |
| C4 | C7 | H4 | 108.2° | 109.5° |
| C4 | C7 | H5 | 108.2° | 109.5° |
| C4 | C5 | C6 | 120.6° | 120.0° |
| C5 | C4 | C3 | 119.4° | 120.0° |
| C4 | C5 | H30 | 119.7° | 120.0° |
| C5 | C6 | C1 | 119.8° | 120.0° |
| C6 | C5 | H30 | 119.7° | 120.0° |
| C5 | C6 | H31 | 120.1° | 120.0° |
| C26 | C21 | C22 | 118.7° | 120.3° |
| C21 | C26 | C25 | 120.8° | 120.1° |
| C21 | C26 | H26 | 119.6° | 119.9° |
| C21 | C22 | C23 | 120.3° | 120.2° |
| C21 | C22 | H11 | 119.8° | 119.9° |
| C4 | C3 | C2 | 120.4° | 120.0° |
| C4 | C3 | H3 | 119.8° | 120.0° |
| C6 | C1 | C2 | 119.9° | 120.0° |
| C6 | C1 | H1 | 120.0° | 120.0° |
| C1 | C6 | H31 | 120.1° | 120.0° |
| C26 | C25 | C24 | 120.2° | 119.9° |
| C25 | C26 | H26 | 119.6° | 120.0° |
| C26 | C25 | H27 | 119.9° | 120.1° |
| C22 | C23 | C24 | 121.1° | 119.8° |
| C23 | C22 | H11 | 119.9° | 119.9° |
| C22 | C23 | H29 | 119.4° | 120.1° |
| C3 | C2 | C1 | 119.8° | 120.0° |
| C3 | C2 | H2 | 120.1° | 120.0° |
| C2 | C3 | H3 | 119.8° | 120.0° |
| C25 | C24 | C23 | 118.8° | 119.7° |
| C25 | C24 | C27 | 121.4° | 120.1° |
| C24 | C25 | H27 | 119.9° | 120.0° |
| C2 | C1 | H1 | 120.1° | 120.0° |
| C1 | C2 | H2 | 120.1° | 120.0° |
| C23 | C24 | C27 | 119.8° | 120.1° |
| C24 | C23 | H29 | 119.5° | 120.1° |
| C24 | C27 | N28 | 119.5° | 120.0° |
| C24 | C27 | N29 | 120.7° | 120.0° |
| N28 | C27 | N29 | 119.8° | 120.1° |
| C27 | N28 | H28 | 112.0° | 119.9° |
| C27 | N29 | H12 | 120.0° | 120.1° |
| C27 | N29 | H13 | 120.0° | 120.0° |
| H4 | C7 | H5 | 109.5° | 109.5° |
| H7 | C16 | H8 | 109.5° | 109.5° |
| H9 | C20 | H10 | 109.5° | 109.5° |
| H12 | N29 | H13 | 120.0° | 119.9° |
| H14 | C30 | H15 | 109.5° | 109.5° |
| H16 | C32 | H17 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C36 | C35 | C34 | H19 | 180.0° | 180.0° |
| C35 | C36 | C37 | H23 | 180.0° | 179.6° |
| C36 | C35 | C34 | C33 | 0.1° | 0.1° |
| C35 | C36 | C37 | C38 | 0.1° | 0.5° |
| C36 | C35 | C34 | H18 | 179.9° | 180.0° |
| C35 | C36 | C37 | H22 | 179.9° | 180.0° |
| C34 | C35 | C36 | C37 | 0.1° | 0.3° |
| C35 | C34 | C33 | H18 | 180.0° | 179.9° |
| C35 | C34 | C33 | C38 | 0.1° | 0.0° |
| C35 | C34 | C33 | C32 | 179.4° | 179.8° |
| C34 | C35 | C36 | H23 | 179.9° | 180.0° |
| C36 | C37 | C38 | H22 | 180.0° | 179.5° |
| C36 | C37 | C38 | C33 | 0.1° | 0.5° |
| C37 | C36 | C35 | H19 | 179.9° | 179.7° |
| C36 | C37 | C38 | H21 | 179.9° | 179.5° |
| C34 | C33 | C38 | C37 | 0.1° | 0.2° |
| C34 | C33 | C38 | C32 | 179.3° | 179.8° |
| C34 | C33 | C32 | O31 | 107.3° | 89.7° |
| C34 | C33 | C32 | H16 | 13.8° | 30.3° |
| C34 | C33 | C32 | H17 | 131.7° | 150.3° |
| C33 | C34 | C35 | H19 | 179.9° | 180.0° |
| C34 | C33 | C38 | H21 | 179.9° | 179.7° |
| C37 | C38 | C33 | H21 | 180.0° | 179.9° |
| C37 | C38 | C33 | C32 | 179.4° | 180.0° |
| C38 | C37 | C36 | H23 | 179.9° | 179.8° |
| C38 | C33 | C32 | O31 | 73.4° | 90.0° |
| C38 | C33 | C32 | H16 | 165.5° | 150.0° |
| C38 | C33 | C32 | H17 | 47.7° | 30.0° |
| C38 | C33 | C34 | H18 | 179.9° | 179.9° |
| C33 | C38 | C37 | H22 | 179.9° | 180.0° |
| C33 | C32 | O31 | C30 | 85.2° | 180.0° |
| C33 | C32 | O31 | H16 | 121.1° | 120.0° |
| C33 | C32 | O31 | H17 | 121.1° | 120.0° |
| C33 | C32 | H16 | H17 | 116.6° | 120.0° |
| C32 | C33 | C34 | H18 | 0.6° | 0.3° |
| C32 | C33 | C38 | H21 | 0.6° | 0.0° |
| C16 | N15 | C13 | H24 | 180.0° | 180.0° |
| N15 | C16 | C17 | H7 | 119.7° | 120.0° |
| N15 | C16 | C17 | H8 | 119.7° | 119.9° |
| C16 | N15 | C13 | C12 | 178.4° | 180.0° |
| C16 | N15 | C13 | O14 | 0.2° | 0.0° |
| N15 | C16 | C17 | N19 | 177.7° | 180.0° |
| N15 | C16 | C17 | O18 | 1.3° | 0.0° |
| N15 | C16 | H7 | H8 | 120.9° | 120.0° |
| N15 | C13 | C12 | C30 | 98.6° | 60.0° |
| C13 | N15 | C16 | C17 | 77.4° | 180.0° |
| N15 | C13 | C12 | O14 | 178.3° | 180.0° |
| N15 | C13 | C12 | N11 | 144.2° | 180.0° |
| N15 | C13 | C12 | H6 | 24.8° | 60.0° |
| C13 | N15 | C16 | H7 | 42.3° | 60.0° |
| C13 | N15 | C16 | H8 | 162.9° | 60.0° |
| O31 | C30 | C12 | H14 | 119.9° | 120.0° |
| O31 | C30 | C12 | H15 | 119.9° | 120.0° |
| O31 | C30 | C12 | C13 | 65.8° | 55.0° |
| O31 | C30 | C12 | N11 | 52.3° | 65.0° |
| O31 | C30 | C12 | H6 | 170.4° | 175.0° |
| O31 | C30 | H14 | H15 | 120.3° | 120.1° |
| C30 | O31 | C32 | H16 | 35.9° | 60.0° |
| C30 | O31 | C32 | H17 | 153.7° | 60.0° |
| C12 | C30 | O31 | C32 | 177.7° | 180.0° |
| C30 | C12 | C13 | N11 | 117.2° | 120.0° |
| C30 | C12 | C13 | H6 | 123.4° | 120.0° |
| C30 | C12 | N11 | H6 | 117.6° | 120.0° |
| C30 | C12 | C13 | O14 | 83.1° | 120.0° |
| C30 | C12 | N11 | S8 | 140.0° | 95.0° |
| C12 | C30 | H14 | H15 | 120.3° | 119.9° |
| C30 | C12 | N11 | H20 | 17.9° | 85.0° |
| C16 | C17 | N19 | O18 | 179.0° | 180.0° |
| C16 | C17 | N19 | C20 | 178.4° | 180.0° |
| C17 | C16 | H7 | H8 | 121.0° | 120.0° |
| C17 | C16 | N15 | H24 | 102.6° | 0.0° |
| C16 | C17 | N19 | H25 | 1.7° | 0.0° |
| C32 | O31 | C30 | H14 | 62.3° | 60.1° |
| C32 | O31 | C30 | H15 | 57.8° | 60.0° |
| O31 | C32 | H16 | H17 | 116.6° | 120.0° |
| C13 | C12 | N11 | H6 | 119.3° | 120.0° |
| C13 | C12 | N11 | S8 | 96.8° | 145.0° |
| C13 | C12 | C30 | H14 | 54.1° | 175.0° |
| C13 | C12 | C30 | H15 | 174.3° | 65.0° |
| C13 | C12 | N11 | H20 | 141.1° | 35.0° |
| C12 | C13 | N15 | H24 | 1.6° | 0.0° |
| N11 | C12 | C13 | O14 | 34.1° | 0.0° |
| C12 | N11 | S8 | H20 | 122.1° | 179.9° |
| C12 | N11 | S8 | O10 | 47.8° | 51.0° |
| C12 | N11 | S8 | C7 | 67.4° | 65.0° |
| C12 | N11 | S8 | O9 | 179.2° | 178.9° |
| N11 | C12 | C30 | H14 | 172.2° | 55.0° |
| N11 | C12 | C30 | H15 | 67.6° | 175.0° |
| O14 | C13 | C12 | H6 | 153.5° | 120.0° |
| O14 | C13 | N15 | H24 | 179.8° | 180.0° |
| C17 | N19 | C20 | H25 | 180.0° | 179.9° |
| C17 | N19 | C20 | C21 | 86.9° | 180.0° |
| N19 | C17 | C16 | H7 | 58.0° | 60.0° |
| N19 | C17 | C16 | H8 | 62.6° | 60.0° |
| C17 | N19 | C20 | H9 | 153.2° | 60.0° |
| C17 | N19 | C20 | H10 | 33.1° | 60.0° |
| O18 | C17 | N19 | C20 | 0.6° | 0.0° |
| O18 | C17 | C16 | H7 | 121.0° | 120.0° |
| O18 | C17 | C16 | H8 | 118.4° | 120.0° |
| O18 | C17 | N19 | H25 | 179.4° | 180.0° |
| N19 | C20 | C21 | H9 | 120.0° | 119.9° |
| N19 | C20 | C21 | H10 | 120.0° | 120.0° |
| N19 | C20 | C21 | C26 | 78.4° | 90.0° |
| N19 | C20 | C21 | C22 | 101.5° | 89.7° |
| N19 | C20 | H9 | H10 | 120.1° | 119.9° |
| N11 | S8 | O10 | C7 | 111.9° | 111.7° |
| N11 | S8 | O10 | O9 | 124.6° | 116.8° |
| N11 | S8 | C7 | O9 | 114.7° | 111.6° |
| N11 | S8 | C7 | C4 | 179.5° | 180.0° |
| N11 | S8 | C7 | H4 | 59.8° | 60.0° |
| N11 | S8 | C7 | H5 | 58.8° | 60.0° |
| S8 | N11 | C12 | H6 | 22.5° | 25.0° |
| O10 | S8 | C7 | O9 | 131.2° | 136.7° |
| O10 | S8 | C7 | C4 | 65.4° | 68.4° |
| O10 | S8 | C7 | H4 | 173.9° | 171.6° |
| O10 | S8 | C7 | H5 | 55.3° | 51.6° |
| O10 | S8 | N11 | H20 | 74.3° | 128.9° |
| C20 | C21 | C26 | C22 | 179.9° | 179.7° |
| C20 | C21 | C26 | C25 | 179.9° | 180.0° |
| C20 | C21 | C22 | C23 | 179.9° | 180.0° |
| C21 | C20 | H9 | H10 | 120.0° | 120.1° |
| C20 | C21 | C22 | H11 | 0.1° | 0.0° |
| C21 | C20 | N19 | H25 | 93.2° | 0.0° |
| C20 | C21 | C26 | H26 | 0.1° | 0.0° |
| S8 | C7 | C4 | H4 | 120.7° | 120.0° |
| S8 | C7 | C4 | H5 | 120.7° | 120.0° |
| S8 | C7 | C4 | C5 | 95.9° | 90.0° |
| S8 | C7 | C4 | C3 | 84.0° | 90.0° |
| S8 | C7 | H4 | H5 | 117.8° | 120.0° |
| C7 | S8 | N11 | H20 | 170.5° | 115.0° |
| O9 | S8 | C7 | C4 | 65.8° | 68.4° |
| O9 | S8 | C7 | H4 | 54.9° | 51.6° |
| O9 | S8 | C7 | H5 | 173.5° | 171.6° |
| O9 | S8 | N11 | H20 | 57.1° | 1.0° |
| C7 | C4 | C5 | C3 | 180.0° | 180.0° |
| C7 | C4 | C5 | C6 | 179.8° | 179.8° |
| C7 | C4 | C3 | C2 | 179.9° | 180.0° |
| C7 | C4 | C3 | H3 | 0.1° | 0.0° |
| C4 | C7 | H4 | H5 | 117.7° | 120.0° |
| C7 | C4 | C5 | H30 | 0.2° | 0.0° |
| C4 | C5 | C6 | H30 | 180.0° | 179.8° |
| C4 | C5 | C6 | C1 | 0.1° | 0.5° |
| C5 | C4 | C3 | C2 | 0.1° | 0.1° |
| C5 | C4 | C3 | H3 | 179.9° | 180.0° |
| C5 | C4 | C7 | H4 | 143.3° | 30.0° |
| C5 | C4 | C7 | H5 | 24.8° | 150.0° |
| C4 | C5 | C6 | H31 | 179.9° | 180.0° |
| C6 | C5 | C4 | C3 | 0.2° | 0.2° |
| C5 | C6 | C1 | H31 | 180.0° | 179.5° |
| C5 | C6 | C1 | C2 | 0.1° | 0.6° |
| C5 | C6 | C1 | H1 | 180.0° | 179.7° |
| C21 | C26 | C25 | H26 | 180.0° | 180.0° |
| C26 | C21 | C22 | C23 | 0.0° | 0.3° |
| C21 | C26 | C25 | C24 | 0.0° | 0.0° |
| C26 | C21 | C20 | H9 | 161.6° | 150.1° |
| C26 | C21 | C20 | H10 | 41.6° | 30.0° |
| C26 | C21 | C22 | H11 | 180.0° | 179.7° |
| C21 | C26 | C25 | H27 | 179.9° | 179.9° |
| C22 | C21 | C26 | C25 | 0.0° | 0.3° |
| C21 | C22 | C23 | H11 | 180.0° | 180.0° |
| C21 | C22 | C23 | C24 | 0.0° | 0.0° |
| C22 | C21 | C20 | H9 | 18.5° | 30.2° |
| C22 | C21 | C20 | H10 | 138.5° | 150.3° |
| C22 | C21 | C26 | H26 | 180.0° | 179.8° |
| C21 | C22 | C23 | H29 | 180.0° | 180.0° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 0.0° | 0.0° |
| C4 | C3 | C2 | H2 | 180.0° | 180.0° |
| C3 | C4 | C7 | H4 | 36.7° | 150.0° |
| C3 | C4 | C7 | H5 | 155.3° | 30.0° |
| C3 | C4 | C5 | H30 | 179.8° | 180.0° |
| C6 | C1 | C2 | C3 | 0.1° | 0.3° |
| C6 | C1 | C2 | H1 | 180.0° | 179.7° |
| C6 | C1 | C2 | H2 | 179.9° | 179.7° |
| C1 | C6 | C5 | H30 | 179.9° | 179.7° |
| C26 | C25 | C24 | H27 | 180.0° | 179.9° |
| C26 | C25 | C24 | C23 | 0.0° | 0.3° |
| C26 | C25 | C24 | C27 | 179.9° | 180.0° |
| C22 | C23 | C24 | C25 | 0.0° | 0.3° |
| C22 | C23 | C24 | H29 | 180.0° | 180.0° |
| C22 | C23 | C24 | C27 | 179.9° | 180.0° |
| C3 | C2 | C1 | H2 | 180.0° | 179.9° |
| C3 | C2 | C1 | H1 | 179.9° | 180.0° |
| C25 | C24 | C23 | C27 | 179.9° | 179.7° |
| C25 | C24 | C27 | N28 | 166.8° | 0.0° |
| C25 | C24 | C27 | N29 | 13.7° | 180.0° |
| C24 | C25 | C26 | H26 | 180.0° | 180.0° |
| C25 | C24 | C23 | H29 | 180.0° | 179.8° |
| C1 | C2 | C3 | H3 | 180.0° | 180.0° |
| C2 | C1 | C6 | H31 | 179.9° | 180.0° |
| C23 | C24 | C27 | N28 | 13.3° | 179.7° |
| C23 | C24 | C27 | N29 | 166.2° | 0.3° |
| C24 | C23 | C22 | H11 | 180.0° | 180.0° |
| C23 | C24 | C25 | H27 | 179.9° | 179.8° |
| C24 | C27 | N28 | N29 | 179.6° | 180.0° |
| C24 | C27 | N29 | H12 | 179.5° | 0.0° |
| C24 | C27 | N29 | H13 | 0.5° | 180.0° |
| C27 | C24 | C25 | H27 | 0.1° | 0.1° |
| C24 | C27 | N28 | H28 | 179.6° | 180.0° |
| C27 | C24 | C23 | H29 | 0.1° | 0.1° |
| N28 | C27 | N29 | H12 | 0.0° | 180.0° |
| N28 | C27 | N29 | H13 | 180.0° | 0.0° |
| C27 | N29 | H12 | H13 | 180.0° | 180.0° |
| N29 | C27 | N28 | H28 | 0.0° | 0.0° |
| H1 | C1 | C2 | H2 | 0.1° | 0.0° |
| H1 | C1 | C6 | H31 | 0.1° | 0.3° |
| H2 | C2 | C3 | H3 | 0.0° | 0.0° |
| H6 | C12 | C30 | H14 | 69.7° | 65.0° |
| H6 | C12 | C30 | H15 | 50.5° | 55.0° |
| H6 | C12 | N11 | H20 | 99.7° | 155.0° |
| H7 | C16 | N15 | H24 | 137.7° | 120.0° |
| H8 | C16 | N15 | H24 | 17.1° | 119.9° |
| H9 | C20 | N19 | H25 | 26.8° | 120.0° |
| H10 | C20 | N19 | H25 | 146.9° | 120.1° |
| H11 | C22 | C23 | H29 | 0.0° | 0.0° |
| H18 | C34 | C35 | H19 | 0.1° | 0.0° |
| H19 | C35 | C36 | H23 | 0.1° | 0.1° |
| H21 | C38 | C37 | H22 | 0.1° | 0.0° |
| H22 | C37 | C36 | H23 | 0.0° | 0.3° |
| H26 | C26 | C25 | H27 | 0.0° | 0.0° |
| H30 | C5 | C6 | H31 | 0.1° | 0.3° |
