VWP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C38 | C39 | doub | 1.36Å | 1.41Å | Aromatic |
| C38 | C36 | sing | 1.41Å | 1.42Å | Aromatic |
| C39 | C40 | sing | 1.39Å | 1.38Å | Aromatic |
| N14 | C15 | sing | 1.47Å | 1.45Å | |
| C35 | C36 | doub | 1.40Å | 1.45Å | Aromatic |
| C35 | C34 | sing | 1.36Å | 1.37Å | Aromatic |
| C36 | C37 | sing | 1.42Å | 1.35Å | Aromatic |
| C34 | C33 | doub | 1.39Å | 1.41Å | Aromatic |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C40 | C41 | doub | 1.36Å | 1.38Å | Aromatic |
| C16 | C17 | sing | 1.53Å | 1.57Å | |
| C37 | C41 | sing | 1.41Å | 1.44Å | Aromatic |
| C37 | C32 | doub | 1.40Å | 1.41Å | Aromatic |
| C33 | C32 | sing | 1.36Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.53Å | 1.56Å | |
| C32 | C31 | sing | 1.51Å | 1.54Å | |
| N2 | C20 | sing | 1.35Å | 1.44Å | |
| C18 | C10 | sing | 1.53Å | 1.54Å | |
| C23 | N28 | sing | 1.46Å | 1.47Å | |
| C23 | C24 | sing | 1.53Å | 1.58Å | |
| C29 | C24 | sing | 1.53Å | 1.57Å | |
| C29 | C19 | sing | 1.53Å | 1.56Å | |
| C20 | O22 | doub | 1.21Å | 1.17Å | |
| C20 | C19 | sing | 1.51Å | 1.49Å | |
| N28 | C27 | sing | 1.38Å | 1.24Å | |
| C31 | C1 | sing | 1.51Å | 1.55Å | |
| N21 | C19 | sing | 1.47Å | 1.48Å | |
| N21 | C11 | sing | 1.35Å | 1.43Å | |
| C10 | C11 | sing | 1.51Å | 1.52Å | |
| C10 | N12 | sing | 1.46Å | 1.47Å | |
| O30 | C1 | doub | 1.21Å | 1.20Å | |
| C11 | O13 | doub | 1.21Å | 1.20Å | |
| C1 | N4 | sing | 1.35Å | 1.53Å | |
| O9 | C3 | doub | 1.21Å | 1.21Å | |
| C27 | N26 | doub | 1.30Å | 1.28Å | |
| C27 | N25 | sing | 1.37Å | 1.28Å | |
| N12 | C3 | sing | 1.35Å | 1.47Å | |
| C3 | C5 | sing | 1.51Å | 1.57Å | |
| N4 | C8 | sing | 1.47Å | 1.30Å | |
| N4 | C5 | sing | 1.47Å | 1.62Å | |
| C8 | C7 | sing | 1.51Å | 1.53Å | |
| C5 | C6 | sing | 1.51Å | 1.29Å | |
| C7 | C6 | doub | 1.30Å | 1.56Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C7 | H3 | sing | 1.08Å | 1.08Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C10 | H6 | sing | 1.09Å | 1.10Å | |
| N12 | H7 | sing | 0.97Å | 1.00Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C29 | H21 | sing | 1.09Å | 1.10Å | |
| C29 | H22 | sing | 1.09Å | 1.10Å | |
| C31 | H23 | sing | 1.09Å | 1.10Å | |
| C31 | H24 | sing | 1.09Å | 1.10Å | |
| C33 | H25 | sing | 1.08Å | 1.08Å | |
| C34 | H26 | sing | 1.08Å | 1.08Å | |
| C35 | H27 | sing | 1.08Å | 1.08Å | |
| C38 | H28 | sing | 1.08Å | 1.08Å | |
| C39 | H29 | sing | 1.08Å | 1.08Å | |
| C40 | H30 | sing | 1.08Å | 1.08Å | |
| C41 | H31 | sing | 1.08Å | 1.08Å | |
| N14 | H32 | sing | 1.01Å | 1.00Å | |
| N14 | H33 | sing | 1.01Å | 1.00Å | |
| N2 | H35 | sing | 0.97Å | 1.00Å | |
| N2 | H36 | sing | 0.97Å | 1.00Å | |
| N21 | H37 | sing | 0.97Å | 1.00Å | |
| N25 | H38 | sing | 0.97Å | 1.00Å | |
| N25 | H39 | sing | 0.97Å | 1.00Å | |
| N26 | H40 | sing | 0.97Å | 1.00Å | |
| N28 | H41 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C39 | C38 | C36 | 119.9° | 119.7° |
| C38 | C39 | C40 | 120.3° | 121.0° |
| C39 | C38 | H28 | 120.1° | 120.2° |
| C38 | C39 | H29 | 119.8° | 119.5° |
| C38 | C36 | C35 | 120.7° | 121.3° |
| C38 | C36 | C37 | 119.3° | 119.3° |
| C36 | C38 | H28 | 120.0° | 120.2° |
| C39 | C40 | C41 | 120.0° | 121.0° |
| C40 | C39 | H29 | 119.8° | 119.5° |
| C39 | C40 | H30 | 120.0° | 119.5° |
| N14 | C15 | C16 | 110.6° | 109.5° |
| N14 | C15 | H8 | 109.2° | 109.5° |
| N14 | C15 | H9 | 109.2° | 109.4° |
| C15 | N14 | H32 | 109.5° | 111.1° |
| C15 | N14 | H33 | 109.4° | 111.0° |
| C36 | C35 | C34 | 119.8° | 119.7° |
| C35 | C36 | C37 | 120.0° | 119.4° |
| C36 | C35 | H27 | 120.1° | 120.2° |
| C35 | C34 | C33 | 119.8° | 121.0° |
| C35 | C34 | H26 | 120.1° | 119.5° |
| C34 | C35 | H27 | 120.1° | 120.1° |
| C36 | C37 | C41 | 120.9° | 119.4° |
| C36 | C37 | C32 | 120.1° | 119.3° |
| C34 | C33 | C32 | 119.9° | 121.0° |
| C34 | C33 | H25 | 120.1° | 119.5° |
| C33 | C34 | H26 | 120.1° | 119.5° |
| C15 | C16 | C17 | 112.9° | 109.5° |
| C16 | C15 | H8 | 109.2° | 109.5° |
| C16 | C15 | H9 | 109.2° | 109.5° |
| C15 | C16 | H14 | 108.6° | 109.5° |
| C15 | C16 | H15 | 108.6° | 109.5° |
| C40 | C41 | C37 | 119.6° | 119.7° |
| C41 | C40 | H30 | 120.0° | 119.5° |
| C40 | C41 | H31 | 120.2° | 120.2° |
| C16 | C17 | C18 | 109.9° | 109.5° |
| C16 | C17 | H10 | 109.4° | 109.5° |
| C16 | C17 | H11 | 109.4° | 109.4° |
| C17 | C16 | H14 | 108.6° | 109.5° |
| C17 | C16 | H15 | 108.6° | 109.5° |
| C41 | C37 | C32 | 119.0° | 121.3° |
| C37 | C41 | H31 | 120.2° | 120.1° |
| C37 | C32 | C33 | 120.4° | 119.6° |
| C37 | C32 | C31 | 118.1° | 120.2° |
| C33 | C32 | C31 | 121.5° | 120.2° |
| C32 | C33 | H25 | 120.1° | 119.4° |
| C17 | C18 | C10 | 115.4° | 109.4° |
| C18 | C17 | H10 | 109.3° | 109.5° |
| C18 | C17 | H11 | 109.4° | 109.5° |
| C17 | C18 | H16 | 108.0° | 109.5° |
| C17 | C18 | H17 | 107.9° | 109.5° |
| C32 | C31 | C1 | 109.5° | 109.5° |
| C32 | C31 | H23 | 109.5° | 109.5° |
| C32 | C31 | H24 | 109.5° | 109.4° |
| N2 | C20 | O22 | 120.5° | 120.0° |
| N2 | C20 | C19 | 119.1° | 120.0° |
| C20 | N2 | H35 | 120.0° | 120.1° |
| C20 | N2 | H36 | 120.0° | 120.0° |
| C18 | C10 | C11 | 113.1° | 109.5° |
| C18 | C10 | N12 | 111.1° | 109.5° |
| C18 | C10 | H6 | 106.8° | 109.5° |
| C10 | C18 | H16 | 107.9° | 109.5° |
| C10 | C18 | H17 | 108.0° | 109.5° |
| N28 | C23 | C24 | 110.7° | 109.5° |
| C23 | N28 | C27 | 121.0° | 120.0° |
| N28 | C23 | H19 | 109.2° | 109.5° |
| N28 | C23 | H20 | 109.2° | 109.4° |
| C23 | N28 | H41 | 119.5° | 120.0° |
| C23 | C24 | C29 | 112.1° | 109.5° |
| C23 | C24 | H12 | 108.8° | 109.5° |
| C23 | C24 | H13 | 108.8° | 109.4° |
| C24 | C23 | H19 | 109.2° | 109.4° |
| C24 | C23 | H20 | 109.2° | 109.5° |
| C24 | C29 | C19 | 114.0° | 109.5° |
| C29 | C24 | H12 | 108.8° | 109.5° |
| C29 | C24 | H13 | 108.8° | 109.5° |
| C24 | C29 | H21 | 108.3° | 109.5° |
| C24 | C29 | H22 | 108.3° | 109.4° |
| C29 | C19 | C20 | 110.7° | 109.5° |
| C29 | C19 | N21 | 106.9° | 109.5° |
| C29 | C19 | H18 | 109.4° | 109.5° |
| C19 | C29 | H21 | 108.3° | 109.4° |
| C19 | C29 | H22 | 108.3° | 109.5° |
| O22 | C20 | C19 | 120.4° | 120.0° |
| C20 | C19 | N21 | 108.7° | 109.5° |
| C20 | C19 | H18 | 110.4° | 109.5° |
| N28 | C27 | N26 | 120.0° | 120.0° |
| N28 | C27 | N25 | 120.4° | 120.0° |
| C27 | N28 | H41 | 119.5° | 120.0° |
| C31 | C1 | O30 | 120.2° | 120.0° |
| C31 | C1 | N4 | 119.7° | 120.0° |
| C1 | C31 | H23 | 109.5° | 109.5° |
| C1 | C31 | H24 | 109.5° | 109.5° |
| C19 | N21 | C11 | 123.6° | 120.0° |
| N21 | C19 | H18 | 110.5° | 109.4° |
| C19 | N21 | H37 | 118.2° | 120.0° |
| N21 | C11 | C10 | 116.6° | 120.0° |
| N21 | C11 | O13 | 122.3° | 120.0° |
| C11 | N21 | H37 | 118.2° | 120.0° |
| C11 | C10 | N12 | 111.0° | 109.5° |
| C10 | C11 | O13 | 121.1° | 120.0° |
| C11 | C10 | H6 | 107.0° | 109.4° |
| C10 | N12 | C3 | 114.6° | 120.0° |
| N12 | C10 | H6 | 107.6° | 109.4° |
| C10 | N12 | H7 | 122.7° | 120.0° |
| O30 | C1 | N4 | 120.1° | 120.0° |
| C1 | N4 | C8 | 127.0° | 127.3° |
| C1 | N4 | C5 | 123.0° | 127.3° |
| O9 | C3 | N12 | 118.7° | 120.0° |
| O9 | C3 | C5 | 119.1° | 120.0° |
| N26 | C27 | N25 | 119.6° | 120.0° |
| C27 | N26 | H40 | 112.0° | 120.0° |
| C27 | N25 | H38 | 120.0° | 120.0° |
| C27 | N25 | H39 | 120.0° | 120.0° |
| N12 | C3 | C5 | 122.1° | 120.0° |
| C3 | N12 | H7 | 122.7° | 120.0° |
| C3 | C5 | N4 | 103.2° | 110.0° |
| C3 | C5 | C6 | 111.6° | 109.9° |
| C3 | C5 | H1 | 109.7° | 109.9° |
| C8 | N4 | C5 | 110.1° | 105.5° |
| N4 | C8 | C7 | 106.8° | 107.2° |
| N4 | C8 | H4 | 110.1° | 109.9° |
| N4 | C8 | H5 | 110.1° | 110.1° |
| N4 | C5 | C6 | 108.6° | 107.1° |
| N4 | C5 | H1 | 109.1° | 109.9° |
| C8 | C7 | C6 | 106.7° | 110.1° |
| C8 | C7 | H3 | 126.7° | 125.0° |
| C7 | C8 | H4 | 110.1° | 109.9° |
| C7 | C8 | H5 | 110.1° | 109.9° |
| C5 | C6 | C7 | 107.2° | 110.2° |
| C6 | C5 | H1 | 114.1° | 109.9° |
| C5 | C6 | H2 | 126.4° | 124.9° |
| C7 | C6 | H2 | 126.4° | 125.0° |
| C6 | C7 | H3 | 126.6° | 124.9° |
| H4 | C8 | H5 | 109.5° | 109.9° |
| H8 | C15 | H9 | 109.5° | 109.4° |
| H10 | C17 | H11 | 109.5° | 109.5° |
| H12 | C24 | H13 | 109.5° | 109.5° |
| H14 | C16 | H15 | 109.5° | 109.4° |
| H16 | C18 | H17 | 109.5° | 109.6° |
| H19 | C23 | H20 | 109.5° | 109.4° |
| H21 | C29 | H22 | 109.5° | 109.5° |
| H23 | C31 | H24 | 109.4° | 109.5° |
| H32 | N14 | H33 | 109.5° | 111.0° |
| H35 | N2 | H36 | 120.0° | 119.9° |
| H38 | N25 | H39 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C39 | C38 | C36 | H28 | 180.0° | 179.9° |
| C38 | C39 | C40 | H29 | 180.0° | 179.9° |
| C39 | C38 | C36 | C35 | 180.0° | 180.0° |
| C39 | C38 | C36 | C37 | 0.2° | 0.3° |
| C38 | C39 | C40 | C41 | 0.1° | 0.2° |
| C38 | C39 | C40 | H30 | 179.9° | 180.0° |
| C36 | C38 | C39 | C40 | 0.1° | 0.1° |
| C38 | C36 | C35 | C37 | 179.8° | 179.7° |
| C38 | C36 | C35 | C34 | 180.0° | 180.0° |
| C38 | C36 | C37 | C41 | 0.2° | 0.3° |
| C38 | C36 | C37 | C32 | 179.8° | 179.8° |
| C38 | C36 | C35 | H27 | 0.0° | 0.3° |
| C36 | C38 | C39 | H29 | 179.9° | 180.0° |
| C39 | C40 | C41 | H30 | 180.0° | 179.9° |
| C39 | C40 | C41 | C37 | 0.1° | 0.2° |
| C40 | C39 | C38 | H28 | 179.9° | 180.0° |
| C39 | C40 | C41 | H31 | 179.9° | 179.8° |
| N14 | C15 | C16 | H8 | 120.2° | 120.0° |
| N14 | C15 | C16 | H9 | 120.2° | 120.0° |
| N14 | C15 | C16 | C17 | 170.1° | 180.0° |
| N14 | C15 | H8 | H9 | 119.5° | 119.9° |
| N14 | C15 | C16 | H14 | 49.5° | 60.0° |
| N14 | C15 | C16 | H15 | 69.4° | 60.0° |
| C15 | N14 | H32 | H33 | 120.0° | 124.0° |
| C36 | C35 | C34 | H27 | 180.0° | 179.8° |
| C36 | C35 | C34 | C33 | 0.1° | 0.0° |
| C35 | C36 | C37 | C41 | 180.0° | 180.0° |
| C35 | C36 | C37 | C32 | 0.0° | 0.5° |
| C36 | C35 | C34 | H26 | 179.9° | 180.0° |
| C35 | C36 | C38 | H28 | 0.0° | 0.1° |
| C34 | C35 | C36 | C37 | 0.2° | 0.2° |
| C35 | C34 | C33 | H26 | 180.0° | 180.0° |
| C35 | C34 | C33 | C32 | 0.2° | 0.0° |
| C35 | C34 | C33 | H25 | 179.8° | 180.0° |
| C36 | C37 | C41 | C40 | 0.0° | 0.0° |
| C36 | C37 | C41 | C32 | 179.9° | 179.5° |
| C36 | C37 | C32 | C33 | 0.3° | 0.5° |
| C36 | C37 | C32 | C31 | 179.6° | 179.8° |
| C37 | C36 | C35 | H27 | 179.8° | 180.0° |
| C37 | C36 | C38 | H28 | 179.8° | 179.8° |
| C36 | C37 | C41 | H31 | 180.0° | 180.0° |
| C34 | C33 | C32 | C37 | 0.4° | 0.3° |
| C34 | C33 | C32 | H25 | 180.0° | 179.9° |
| C34 | C33 | C32 | C31 | 179.7° | 180.0° |
| C33 | C34 | C35 | H27 | 179.9° | 179.8° |
| C15 | C16 | C17 | H14 | 120.5° | 120.0° |
| C15 | C16 | C17 | H15 | 120.5° | 120.0° |
| C15 | C16 | C17 | C18 | 26.1° | 180.0° |
| C16 | C15 | H8 | H9 | 119.5° | 120.0° |
| C15 | C16 | C17 | H10 | 94.0° | 60.0° |
| C15 | C16 | C17 | H11 | 146.2° | 60.0° |
| C15 | C16 | H14 | H15 | 118.4° | 120.0° |
| C16 | C15 | N14 | H32 | 180.0° | 180.0° |
| C16 | C15 | N14 | H33 | 60.0° | 56.0° |
| C40 | C41 | C37 | H31 | 180.0° | 180.0° |
| C40 | C41 | C37 | C32 | 179.9° | 179.5° |
| C41 | C40 | C39 | H29 | 179.9° | 179.7° |
| C16 | C17 | C18 | H10 | 120.1° | 120.0° |
| C16 | C17 | C18 | H11 | 120.1° | 120.0° |
| C16 | C17 | C18 | C10 | 156.7° | 180.0° |
| C17 | C16 | C15 | H8 | 69.8° | 60.0° |
| C17 | C16 | C15 | H9 | 49.9° | 60.0° |
| C16 | C17 | H10 | H11 | 119.8° | 120.0° |
| C17 | C16 | H14 | H15 | 118.4° | 119.9° |
| C16 | C17 | C18 | H16 | 35.9° | 60.0° |
| C16 | C17 | C18 | H17 | 82.4° | 60.1° |
| C41 | C37 | C32 | C33 | 179.7° | 180.0° |
| C41 | C37 | C32 | C31 | 0.5° | 0.2° |
| C37 | C41 | C40 | H30 | 179.8° | 179.9° |
| C37 | C32 | C33 | C31 | 179.2° | 179.7° |
| C37 | C32 | C31 | C1 | 104.0° | 84.8° |
| C37 | C32 | C31 | H23 | 16.0° | 35.3° |
| C37 | C32 | C31 | H24 | 136.0° | 155.3° |
| C37 | C32 | C33 | H25 | 179.6° | 179.8° |
| C32 | C37 | C41 | H31 | 0.1° | 0.4° |
| C33 | C32 | C31 | C1 | 75.2° | 95.0° |
| C33 | C32 | C31 | H23 | 164.7° | 145.0° |
| C33 | C32 | C31 | H24 | 44.8° | 25.0° |
| C32 | C33 | C34 | H26 | 179.8° | 180.0° |
| C17 | C18 | C10 | H16 | 120.9° | 120.0° |
| C17 | C18 | C10 | H17 | 120.9° | 119.9° |
| C17 | C18 | C10 | C11 | 21.0° | 175.0° |
| C17 | C18 | C10 | N12 | 104.6° | 65.0° |
| C17 | C18 | C10 | H6 | 138.4° | 55.0° |
| C18 | C17 | H10 | H11 | 119.8° | 120.0° |
| C18 | C17 | C16 | H14 | 146.6° | 60.0° |
| C18 | C17 | C16 | H15 | 94.4° | 59.9° |
| C17 | C18 | H16 | H17 | 117.3° | 120.0° |
| C32 | C31 | C1 | H23 | 120.0° | 120.0° |
| C32 | C31 | C1 | H24 | 120.0° | 120.0° |
| C32 | C31 | C1 | O30 | 62.6° | 0.1° |
| C32 | C31 | C1 | N4 | 116.4° | 179.9° |
| C32 | C31 | H23 | H24 | 120.0° | 120.0° |
| C31 | C32 | C33 | H25 | 0.3° | 0.0° |
| N2 | C20 | C19 | C29 | 76.0° | 60.0° |
| N2 | C20 | O22 | C19 | 179.5° | 179.9° |
| N2 | C20 | C19 | N21 | 41.3° | 179.9° |
| N2 | C20 | C19 | H18 | 162.7° | 60.0° |
| C20 | N2 | H35 | H36 | 180.0° | 179.9° |
| C18 | C10 | C11 | N21 | 90.8° | 60.0° |
| C18 | C10 | C11 | N12 | 125.6° | 120.1° |
| C18 | C10 | C11 | H6 | 117.3° | 120.0° |
| C18 | C10 | N12 | H6 | 116.6° | 120.1° |
| C18 | C10 | C11 | O13 | 91.1° | 120.0° |
| C18 | C10 | N12 | C3 | 82.3° | 85.0° |
| C18 | C10 | N12 | H7 | 97.7° | 95.0° |
| C10 | C18 | C17 | H10 | 83.2° | 60.0° |
| C10 | C18 | C17 | H11 | 36.6° | 60.1° |
| C10 | C18 | H16 | H17 | 117.3° | 120.0° |
| N28 | C23 | C24 | H19 | 120.2° | 120.0° |
| N28 | C23 | C24 | H20 | 120.2° | 120.0° |
| N28 | C23 | C24 | C29 | 71.5° | 180.0° |
| C23 | N28 | C27 | H41 | 180.0° | 179.9° |
| C23 | N28 | C27 | N26 | 179.9° | 180.0° |
| C23 | N28 | C27 | N25 | 0.2° | 0.1° |
| N28 | C23 | C24 | H12 | 48.8° | 60.0° |
| N28 | C23 | C24 | H13 | 168.0° | 60.0° |
| N28 | C23 | H19 | H20 | 119.4° | 119.9° |
| C23 | C24 | C29 | H12 | 120.4° | 120.0° |
| C23 | C24 | C29 | H13 | 120.4° | 119.9° |
| C23 | C24 | C29 | C19 | 173.9° | 180.0° |
| C24 | C23 | N28 | C27 | 79.8° | 179.9° |
| C23 | C24 | H12 | H13 | 118.8° | 119.9° |
| C24 | C23 | H19 | H20 | 119.4° | 120.0° |
| C23 | C24 | C29 | H21 | 53.2° | 60.0° |
| C23 | C24 | C29 | H22 | 65.4° | 60.1° |
| C24 | C23 | N28 | H41 | 100.2° | 0.0° |
| C24 | C29 | C19 | H21 | 120.7° | 120.0° |
| C24 | C29 | C19 | H22 | 120.7° | 119.9° |
| C24 | C29 | C19 | C20 | 73.9° | 175.0° |
| C24 | C29 | C19 | N21 | 167.8° | 65.0° |
| C29 | C24 | H12 | H13 | 118.8° | 120.0° |
| C24 | C29 | C19 | H18 | 48.0° | 55.0° |
| C29 | C24 | C23 | H19 | 168.2° | 60.0° |
| C29 | C24 | C23 | H20 | 48.6° | 59.9° |
| C24 | C29 | H21 | H22 | 117.9° | 120.0° |
| C29 | C19 | C20 | O22 | 104.6° | 120.0° |
| C29 | C19 | C20 | N21 | 117.2° | 120.0° |
| C29 | C19 | C20 | H18 | 121.4° | 120.0° |
| C29 | C19 | N21 | H18 | 119.0° | 120.0° |
| C29 | C19 | N21 | C11 | 179.2° | 155.0° |
| C19 | C29 | C24 | H12 | 65.7° | 60.0° |
| C19 | C29 | C24 | H13 | 53.5° | 60.0° |
| C19 | C29 | H21 | H22 | 117.9° | 120.0° |
| C29 | C19 | N21 | H37 | 0.8° | 25.0° |
| O22 | C20 | C19 | N21 | 138.2° | 0.0° |
| O22 | C20 | C19 | H18 | 16.8° | 120.0° |
| O22 | C20 | N2 | H35 | 0.0° | 0.0° |
| O22 | C20 | N2 | H36 | 180.0° | 180.0° |
| C20 | C19 | N21 | H18 | 121.4° | 120.0° |
| C20 | C19 | N21 | C11 | 59.6° | 85.0° |
| C20 | C19 | C29 | H21 | 46.7° | 55.0° |
| C20 | C19 | C29 | H22 | 165.4° | 65.0° |
| C19 | C20 | N2 | H35 | 179.5° | 180.0° |
| C19 | C20 | N2 | H36 | 0.5° | 0.1° |
| C20 | C19 | N21 | H37 | 120.4° | 95.0° |
| N28 | C27 | N26 | N25 | 179.9° | 179.9° |
| C27 | N28 | C23 | H19 | 40.4° | 59.9° |
| C27 | N28 | C23 | H20 | 160.0° | 60.0° |
| N28 | C27 | N25 | H38 | 179.9° | 180.0° |
| N28 | C27 | N25 | H39 | 0.1° | 0.0° |
| N28 | C27 | N26 | H40 | 179.9° | 180.0° |
| C31 | C1 | O30 | N4 | 179.0° | 179.9° |
| C31 | C1 | N4 | C8 | 0.1° | 0.1° |
| C31 | C1 | N4 | C5 | 179.1° | 179.9° |
| C1 | C31 | H23 | H24 | 120.0° | 120.0° |
| C19 | N21 | C11 | H37 | 180.0° | 180.0° |
| C19 | N21 | C11 | C10 | 179.4° | 180.0° |
| C19 | N21 | C11 | O13 | 1.3° | 0.0° |
| N21 | C19 | C29 | H21 | 71.6° | 175.0° |
| N21 | C19 | C29 | H22 | 47.1° | 55.0° |
| N21 | C11 | C10 | O13 | 178.1° | 180.0° |
| N21 | C11 | C10 | N12 | 143.5° | 180.0° |
| N21 | C11 | C10 | H6 | 26.4° | 60.0° |
| C11 | N21 | C19 | H18 | 61.8° | 35.0° |
| C11 | C10 | N12 | H6 | 116.7° | 119.9° |
| C11 | C10 | N12 | C3 | 151.0° | 155.0° |
| C11 | C10 | N12 | H7 | 29.0° | 25.0° |
| C11 | C10 | C18 | H16 | 141.9° | 65.1° |
| C11 | C10 | C18 | H17 | 99.8° | 55.0° |
| C10 | C11 | N21 | H37 | 0.6° | 0.0° |
| N12 | C10 | C11 | O13 | 34.6° | 0.0° |
| C10 | N12 | C3 | O9 | 1.9° | 0.1° |
| C10 | N12 | C3 | H7 | 180.0° | 180.0° |
| C10 | N12 | C3 | C5 | 179.8° | 180.0° |
| N12 | C10 | C18 | H16 | 16.3° | 55.0° |
| N12 | C10 | C18 | H17 | 134.6° | 175.1° |
| O30 | C1 | N4 | C8 | 179.0° | 180.0° |
| O30 | C1 | N4 | C5 | 0.1° | 0.2° |
| O30 | C1 | C31 | H23 | 57.4° | 119.9° |
| O30 | C1 | C31 | H24 | 177.4° | 120.0° |
| O13 | C11 | C10 | H6 | 151.7° | 120.0° |
| O13 | C11 | N21 | H37 | 178.7° | 180.0° |
| C1 | N4 | C5 | C3 | 53.2° | 60.7° |
| C1 | N4 | C8 | C5 | 179.2° | 179.8° |
| C1 | N4 | C8 | C7 | 175.8° | 179.9° |
| C1 | N4 | C5 | C6 | 171.7° | 179.9° |
| C1 | N4 | C5 | H1 | 63.4° | 60.5° |
| C1 | N4 | C8 | H4 | 64.6° | 60.8° |
| C1 | N4 | C8 | H5 | 56.2° | 60.4° |
| N4 | C1 | C31 | H23 | 123.6° | 59.9° |
| N4 | C1 | C31 | H24 | 3.6° | 60.1° |
| O9 | C3 | N12 | C5 | 177.9° | 180.0° |
| O9 | C3 | C5 | N4 | 55.3° | 0.8° |
| O9 | C3 | C5 | C6 | 61.2° | 118.5° |
| O9 | C3 | C5 | H1 | 171.4° | 120.4° |
| O9 | C3 | N12 | H7 | 178.1° | 180.0° |
| N26 | C27 | N25 | H38 | 0.0° | 0.0° |
| N26 | C27 | N25 | H39 | 180.0° | 180.0° |
| N26 | C27 | N28 | H41 | 0.1° | 0.1° |
| C27 | N25 | H38 | H39 | 180.0° | 180.0° |
| N25 | C27 | N26 | H40 | 0.0° | 0.1° |
| N25 | C27 | N28 | H41 | 179.8° | 180.0° |
| N12 | C3 | C5 | N4 | 122.6° | 179.2° |
| N12 | C3 | C5 | C6 | 120.9° | 61.5° |
| N12 | C3 | C5 | H1 | 6.5° | 59.6° |
| C3 | N12 | C10 | H6 | 34.3° | 35.1° |
| C3 | C5 | N4 | C8 | 126.1° | 119.5° |
| C3 | C5 | N4 | C6 | 118.5° | 119.4° |
| C3 | C5 | N4 | H1 | 116.6° | 121.2° |
| C3 | C5 | C6 | H1 | 125.0° | 121.1° |
| C3 | C5 | C6 | C7 | 120.6° | 119.6° |
| C3 | C5 | C6 | H2 | 59.4° | 60.5° |
| C5 | C3 | N12 | H7 | 0.2° | 0.0° |
| N4 | C8 | C7 | H4 | 119.6° | 119.4° |
| N4 | C8 | C7 | H5 | 119.6° | 119.6° |
| C8 | N4 | C5 | C6 | 7.5° | 0.1° |
| N4 | C8 | C7 | C6 | 0.8° | 0.0° |
| C8 | N4 | C5 | H1 | 117.3° | 119.4° |
| N4 | C8 | C7 | H3 | 179.3° | 180.0° |
| N4 | C8 | H4 | H5 | 121.2° | 121.3° |
| C5 | N4 | C8 | C7 | 3.5° | 0.0° |
| N4 | C5 | C6 | H1 | 121.9° | 119.4° |
| N4 | C5 | C6 | C7 | 7.4° | 0.1° |
| N4 | C5 | C6 | H2 | 172.6° | 180.0° |
| C5 | N4 | C8 | H4 | 116.1° | 119.4° |
| C5 | N4 | C8 | H5 | 123.1° | 119.4° |
| C8 | C7 | C6 | C5 | 5.6° | 0.0° |
| C8 | C7 | C6 | H3 | 180.0° | 180.0° |
| C8 | C7 | C6 | H2 | 174.4° | 180.0° |
| C7 | C8 | H4 | H5 | 121.2° | 121.1° |
| C5 | C6 | C7 | H2 | 180.0° | 180.0° |
| C5 | C6 | C7 | H3 | 174.4° | 180.0° |
| C7 | C6 | C5 | H1 | 114.4° | 119.4° |
| C6 | C7 | C8 | H4 | 120.3° | 119.4° |
| C6 | C7 | C8 | H5 | 118.8° | 119.6° |
| H1 | C5 | C6 | H2 | 65.6° | 60.6° |
| H2 | C6 | C7 | H3 | 5.6° | 0.0° |
| H3 | C7 | C8 | H4 | 59.7° | 60.6° |
| H3 | C7 | C8 | H5 | 61.2° | 60.5° |
| H6 | C10 | N12 | H7 | 145.7° | 144.9° |
| H6 | C10 | C18 | H16 | 100.8° | 175.0° |
| H6 | C10 | C18 | H17 | 17.5° | 64.9° |
| H8 | C15 | C16 | H14 | 169.7° | 60.0° |
| H8 | C15 | C16 | H15 | 50.7° | 180.0° |
| H8 | C15 | N14 | H32 | 59.8° | 59.9° |
| H8 | C15 | N14 | H33 | 60.2° | 176.1° |
| H9 | C15 | C16 | H14 | 70.6° | 180.0° |
| H9 | C15 | C16 | H15 | 170.4° | 60.0° |
| H9 | C15 | N14 | H32 | 59.8° | 60.0° |
| H9 | C15 | N14 | H33 | 179.8° | 64.0° |
| H10 | C17 | C16 | H14 | 26.6° | 180.0° |
| H10 | C17 | C16 | H15 | 145.5° | 60.1° |
| H10 | C17 | C18 | H16 | 156.0° | 60.0° |
| H10 | C17 | C18 | H17 | 37.7° | 179.9° |
| H11 | C17 | C16 | H14 | 93.3° | 60.0° |
| H11 | C17 | C16 | H15 | 25.7° | 179.9° |
| H11 | C17 | C18 | H16 | 84.2° | 180.0° |
| H11 | C17 | C18 | H17 | 157.5° | 59.9° |
| H12 | C24 | C23 | H19 | 71.4° | 60.1° |
| H12 | C24 | C23 | H20 | 169.0° | 180.0° |
| H12 | C24 | C29 | H21 | 173.6° | 180.0° |
| H12 | C24 | C29 | H22 | 55.0° | 60.0° |
| H13 | C24 | C23 | H19 | 47.8° | 180.0° |
| H13 | C24 | C23 | H20 | 71.8° | 60.0° |
| H13 | C24 | C29 | H21 | 67.2° | 60.0° |
| H13 | C24 | C29 | H22 | 174.2° | 180.0° |
| H18 | C19 | C29 | H21 | 168.7° | 65.0° |
| H18 | C19 | C29 | H22 | 72.7° | 175.0° |
| H18 | C19 | N21 | H37 | 118.2° | 145.0° |
| H19 | C23 | N28 | H41 | 139.6° | 120.0° |
| H20 | C23 | N28 | H41 | 19.9° | 120.1° |
| H25 | C33 | C34 | H26 | 0.2° | 0.0° |
| H26 | C34 | C35 | H27 | 0.1° | 0.2° |
| H28 | C38 | C39 | H29 | 0.1° | 0.1° |
| H29 | C39 | C40 | H30 | 0.1° | 0.1° |
| H30 | C40 | C41 | H31 | 0.2° | 0.0° |
