3Y3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N38 | C37 | sing | 1.47Å | 1.48Å | |
| C37 | C31 | sing | 1.51Å | 1.52Å | |
| CL | C7 | sing | 1.74Å | 1.71Å | |
| C21 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C31 | C32 | doub | 1.38Å | 1.39Å | Aromatic |
| C31 | C30 | sing | 1.38Å | 1.41Å | Aromatic |
| C32 | C33 | sing | 1.38Å | 1.39Å | Aromatic |
| N6 | C7 | sing | 1.37Å | 1.37Å | Aromatic |
| N6 | C5 | sing | 1.36Å | 1.39Å | Aromatic |
| C26 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
| C27 | C22 | sing | 1.51Å | 1.51Å | |
| C27 | C3 | sing | 1.53Å | 1.54Å | |
| C7 | C8 | doub | 1.36Å | 1.37Å | Aromatic |
| C30 | C1 | sing | 1.51Å | 1.50Å | |
| C30 | C35 | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | N2 | sing | 1.46Å | 1.45Å | |
| C33 | C34 | doub | 1.38Å | 1.38Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| N4 | C3 | sing | 1.47Å | 1.45Å | |
| N4 | C28 | sing | 1.35Å | 1.36Å | |
| C5 | C3 | sing | 1.51Å | 1.50Å | |
| C5 | N9 | doub | 1.30Å | 1.31Å | Aromatic |
| C35 | C34 | sing | 1.38Å | 1.37Å | Aromatic |
| C34 | CL1 | sing | 1.74Å | 1.74Å | |
| N2 | C28 | sing | 1.35Å | 1.34Å | |
| C25 | C24 | doub | 1.38Å | 1.37Å | Aromatic |
| C8 | N9 | sing | 1.35Å | 1.38Å | Aromatic |
| C8 | C11 | sing | 1.48Å | 1.47Å | |
| C28 | O29 | doub | 1.22Å | 1.23Å | |
| C23 | C24 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C12 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | C14 | sing | 1.40Å | 1.40Å | Aromatic |
| N17 | C16 | sing | 1.37Å | 1.36Å | Aromatic |
| N17 | N18 | sing | 1.40Å | 1.37Å | Aromatic |
| C16 | C15 | doub | 1.41Å | 1.41Å | Aromatic |
| C14 | C13 | doub | 1.36Å | 1.38Å | Aromatic |
| N18 | C19 | doub | 1.31Å | 1.33Å | Aromatic |
| C15 | C13 | sing | 1.40Å | 1.39Å | Aromatic |
| C15 | C19 | sing | 1.46Å | 1.46Å | Aromatic |
| C19 | N20 | sing | 1.40Å | 1.34Å | |
| C13 | H46 | sing | 1.08Å | 1.08Å | |
| C21 | H51 | sing | 1.08Å | 1.08Å | |
| C23 | H52 | sing | 1.08Å | 1.08Å | |
| C24 | H53 | sing | 1.08Å | 1.08Å | |
| C12 | H45 | sing | 1.08Å | 1.08Å | |
| C27 | H57 | sing | 1.09Å | 1.10Å | |
| C27 | H56 | sing | 1.09Å | 1.10Å | |
| C33 | H59 | sing | 1.08Å | 1.08Å | |
| C1 | H40 | sing | 1.09Å | 1.10Å | |
| C1 | H39 | sing | 1.09Å | 1.10Å | |
| N2 | H41 | sing | 0.97Å | 1.00Å | |
| C3 | H42 | sing | 1.09Å | 1.10Å | |
| N4 | H43 | sing | 0.97Å | 1.00Å | |
| N6 | H44 | sing | 0.97Å | 1.00Å | |
| C14 | H47 | sing | 1.08Å | 1.08Å | |
| N17 | H48 | sing | 0.97Å | 1.00Å | |
| N20 | H49 | sing | 0.97Å | 1.00Å | |
| N20 | H50 | sing | 0.97Å | 1.00Å | |
| C25 | H54 | sing | 1.08Å | 1.08Å | |
| C26 | H55 | sing | 1.08Å | 1.08Å | |
| C32 | H58 | sing | 1.08Å | 1.08Å | |
| C35 | H60 | sing | 1.08Å | 1.08Å | |
| C37 | H62 | sing | 1.09Å | 1.10Å | |
| C37 | H61 | sing | 1.09Å | 1.10Å | |
| N38 | H64 | sing | 1.01Å | 1.00Å | |
| N38 | H63 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N38 | C37 | C31 | 113.7° | 109.5° |
| N38 | C37 | H62 | 108.4° | 109.5° |
| N38 | C37 | H61 | 108.4° | 109.5° |
| C37 | N38 | H64 | 109.5° | 111.0° |
| C37 | N38 | H63 | 109.4° | 111.0° |
| C37 | C31 | C32 | 117.7° | 120.0° |
| C37 | C31 | C30 | 123.3° | 119.9° |
| C31 | C37 | H62 | 108.4° | 109.4° |
| C31 | C37 | H61 | 108.4° | 109.5° |
| CL | C7 | N6 | 121.4° | 126.7° |
| CL | C7 | C8 | 131.9° | 126.7° |
| C26 | C21 | C22 | 120.7° | 120.0° |
| C21 | C26 | C25 | 120.3° | 120.0° |
| C26 | C21 | H51 | 119.7° | 120.0° |
| C21 | C26 | H55 | 119.9° | 120.0° |
| C21 | C22 | C27 | 120.4° | 120.0° |
| C21 | C22 | C23 | 118.2° | 120.0° |
| C22 | C21 | H51 | 119.7° | 120.0° |
| C32 | C31 | C30 | 119.0° | 120.0° |
| C31 | C32 | C33 | 121.1° | 120.0° |
| C31 | C32 | H58 | 119.4° | 119.9° |
| C31 | C30 | C1 | 120.6° | 120.0° |
| C31 | C30 | C35 | 119.1° | 120.0° |
| C32 | C33 | C34 | 119.0° | 120.0° |
| C32 | C33 | H59 | 120.5° | 120.0° |
| C33 | C32 | H58 | 119.5° | 120.0° |
| C7 | N6 | C5 | 105.6° | 107.3° |
| N6 | C7 | C8 | 106.7° | 106.7° |
| C7 | N6 | H44 | 127.2° | 126.3° |
| N6 | C5 | C3 | 122.9° | 125.5° |
| N6 | C5 | N9 | 112.1° | 109.0° |
| C5 | N6 | H44 | 127.2° | 126.4° |
| C26 | C25 | C24 | 119.7° | 120.0° |
| C26 | C25 | H54 | 120.2° | 120.0° |
| C25 | C26 | H55 | 119.8° | 120.0° |
| C22 | C27 | C3 | 112.0° | 109.5° |
| C27 | C22 | C23 | 120.8° | 120.0° |
| C22 | C27 | H57 | 108.8° | 109.5° |
| C22 | C27 | H56 | 108.8° | 109.5° |
| C27 | C3 | N4 | 111.9° | 109.5° |
| C27 | C3 | C5 | 111.9° | 109.5° |
| C3 | C27 | H57 | 108.8° | 109.5° |
| C3 | C27 | H56 | 108.8° | 109.4° |
| C27 | C3 | H42 | 106.8° | 109.5° |
| C7 | C8 | N9 | 110.4° | 107.8° |
| C7 | C8 | C11 | 131.0° | 126.1° |
| C1 | C30 | C35 | 120.1° | 120.0° |
| C30 | C1 | N2 | 112.9° | 109.5° |
| C30 | C1 | H40 | 108.6° | 109.4° |
| C30 | C1 | H39 | 108.6° | 109.5° |
| C30 | C35 | C34 | 120.4° | 120.0° |
| C30 | C35 | H60 | 119.8° | 120.0° |
| C1 | N2 | C28 | 122.5° | 120.0° |
| N2 | C1 | H40 | 108.6° | 109.4° |
| N2 | C1 | H39 | 108.6° | 109.5° |
| C1 | N2 | H41 | 118.8° | 120.0° |
| C33 | C34 | C35 | 121.4° | 120.0° |
| C33 | C34 | CL1 | 119.7° | 120.0° |
| C34 | C33 | H59 | 120.5° | 120.0° |
| C22 | C23 | C24 | 120.9° | 120.0° |
| C22 | C23 | H52 | 119.5° | 120.0° |
| C3 | N4 | C28 | 118.5° | 120.0° |
| N4 | C3 | C5 | 110.8° | 109.4° |
| N4 | C3 | H42 | 107.9° | 109.4° |
| C3 | N4 | H43 | 120.7° | 120.0° |
| N4 | C28 | N2 | 115.4° | 120.0° |
| N4 | C28 | O29 | 122.5° | 120.0° |
| C28 | N4 | H43 | 120.8° | 120.0° |
| C3 | C5 | N9 | 125.0° | 125.5° |
| C5 | C3 | H42 | 107.3° | 109.5° |
| C5 | N9 | C8 | 105.2° | 109.2° |
| C35 | C34 | CL1 | 118.9° | 120.0° |
| C34 | C35 | H60 | 119.8° | 120.0° |
| N2 | C28 | O29 | 122.0° | 120.0° |
| C28 | N2 | H41 | 118.8° | 120.0° |
| C25 | C24 | C23 | 120.1° | 120.0° |
| C25 | C24 | H53 | 119.9° | 120.0° |
| C24 | C25 | H54 | 120.2° | 120.0° |
| N9 | C8 | C11 | 118.5° | 126.1° |
| C8 | C11 | C12 | 120.3° | 119.8° |
| C8 | C11 | C14 | 119.8° | 119.9° |
| C24 | C23 | H52 | 119.6° | 120.0° |
| C23 | C24 | H53 | 119.9° | 120.0° |
| C11 | C12 | C16 | 118.9° | 119.6° |
| C12 | C11 | C14 | 119.8° | 120.4° |
| C11 | C12 | H45 | 120.5° | 120.2° |
| C12 | C16 | N17 | 131.4° | 133.6° |
| C12 | C16 | C15 | 121.5° | 119.6° |
| C16 | C12 | H45 | 120.5° | 120.2° |
| C11 | C14 | C13 | 120.9° | 120.5° |
| C11 | C14 | H47 | 119.5° | 119.7° |
| C16 | N17 | N18 | 112.4° | 109.2° |
| N17 | C16 | C15 | 107.0° | 106.8° |
| C16 | N17 | H48 | 123.8° | 125.4° |
| N17 | N18 | C19 | 106.1° | 110.1° |
| N18 | N17 | H48 | 123.8° | 125.4° |
| C16 | C15 | C13 | 118.5° | 120.0° |
| C16 | C15 | C19 | 103.9° | 106.2° |
| C14 | C13 | C15 | 120.2° | 120.0° |
| C14 | C13 | H46 | 119.9° | 120.0° |
| C13 | C14 | H47 | 119.5° | 119.8° |
| N18 | C19 | C15 | 110.6° | 107.7° |
| N18 | C19 | N20 | 122.1° | 126.2° |
| C13 | C15 | C19 | 137.4° | 133.8° |
| C15 | C13 | H46 | 119.9° | 120.0° |
| C15 | C19 | N20 | 127.2° | 126.1° |
| C19 | N20 | H49 | 109.5° | 120.0° |
| C19 | N20 | H50 | 109.5° | 120.0° |
| H57 | C27 | H56 | 109.4° | 109.5° |
| H40 | C1 | H39 | 109.5° | 109.5° |
| H49 | N20 | H50 | 109.4° | 120.0° |
| H62 | C37 | H61 | 109.5° | 109.5° |
| H64 | N38 | H63 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N38 | C37 | C31 | H62 | 120.6° | 120.0° |
| N38 | C37 | C31 | H61 | 120.6° | 120.1° |
| N38 | C37 | C31 | C32 | 87.0° | 99.9° |
| N38 | C37 | C31 | C30 | 93.2° | 80.2° |
| N38 | C37 | H62 | H61 | 118.1° | 120.0° |
| C37 | N38 | H64 | H63 | 120.0° | 124.0° |
| C37 | C31 | C32 | C30 | 179.8° | 179.8° |
| C37 | C31 | C32 | C33 | 179.2° | 180.0° |
| C37 | C31 | C30 | C1 | 4.8° | 0.0° |
| C37 | C31 | C30 | C35 | 179.3° | 180.0° |
| C37 | C31 | C32 | H58 | 0.8° | 0.0° |
| C31 | C37 | H62 | H61 | 118.1° | 120.0° |
| C31 | C37 | N38 | H64 | 180.0° | 56.0° |
| C31 | C37 | N38 | H63 | 60.0° | 180.0° |
| CL | C7 | N6 | C8 | 179.0° | 180.0° |
| CL | C7 | N6 | C5 | 178.4° | 180.0° |
| CL | C7 | C8 | N9 | 178.7° | 179.8° |
| CL | C7 | C8 | C11 | 1.1° | 0.0° |
| CL | C7 | N6 | H44 | 1.7° | 0.1° |
| C26 | C21 | C22 | H51 | 180.0° | 179.6° |
| C21 | C26 | C25 | H55 | 180.0° | 179.9° |
| C26 | C21 | C22 | C27 | 166.6° | 180.0° |
| C26 | C21 | C22 | C23 | 4.1° | 0.1° |
| C21 | C26 | C25 | C24 | 1.3° | 0.1° |
| C21 | C26 | C25 | H54 | 178.7° | 179.9° |
| C22 | C21 | C26 | C25 | 1.5° | 0.1° |
| C21 | C22 | C27 | C23 | 170.5° | 180.0° |
| C21 | C22 | C27 | C3 | 118.9° | 90.0° |
| C21 | C22 | C23 | C24 | 4.2° | 0.0° |
| C21 | C22 | C23 | H52 | 175.9° | 179.9° |
| C21 | C22 | C27 | H57 | 1.5° | 150.0° |
| C21 | C22 | C27 | H56 | 120.7° | 30.0° |
| C22 | C21 | C26 | H55 | 178.5° | 180.0° |
| C31 | C32 | C33 | H58 | 180.0° | 180.0° |
| C32 | C31 | C30 | C1 | 175.0° | 179.8° |
| C32 | C31 | C30 | C35 | 0.9° | 0.2° |
| C31 | C32 | C33 | C34 | 0.9° | 0.1° |
| C31 | C32 | C33 | H59 | 179.1° | 180.0° |
| C32 | C31 | C37 | H62 | 152.4° | 20.1° |
| C32 | C31 | C37 | H61 | 33.6° | 140.0° |
| C30 | C31 | C32 | C33 | 0.9° | 0.2° |
| C31 | C30 | C1 | C35 | 175.9° | 180.0° |
| C31 | C30 | C1 | N2 | 68.3° | 79.9° |
| C31 | C30 | C35 | C34 | 0.9° | 0.0° |
| C31 | C30 | C1 | H40 | 171.2° | 40.0° |
| C31 | C30 | C1 | H39 | 52.2° | 160.0° |
| C30 | C31 | C32 | H58 | 179.1° | 179.8° |
| C31 | C30 | C35 | H60 | 179.1° | 180.0° |
| C30 | C31 | C37 | H62 | 27.4° | 159.8° |
| C30 | C31 | C37 | H61 | 146.2° | 39.8° |
| C32 | C33 | C34 | H59 | 180.0° | 179.9° |
| C32 | C33 | C34 | C35 | 0.9° | 0.3° |
| C32 | C33 | C34 | CL1 | 176.8° | 180.0° |
| C7 | N6 | C5 | H44 | 180.0° | 180.0° |
| C7 | N6 | C5 | C3 | 176.6° | 180.0° |
| C7 | N6 | C5 | N9 | 0.9° | 0.2° |
| N6 | C7 | C8 | N9 | 0.2° | 0.2° |
| N6 | C7 | C8 | C11 | 177.8° | 180.0° |
| N6 | C5 | C3 | C27 | 63.5° | 125.3° |
| C5 | N6 | C7 | C8 | 0.6° | 0.0° |
| N6 | C5 | C3 | N4 | 62.1° | 5.2° |
| N6 | C5 | C3 | N9 | 177.2° | 179.8° |
| N6 | C5 | N9 | C8 | 0.8° | 0.4° |
| N6 | C5 | C3 | H42 | 179.6° | 114.7° |
| C26 | C25 | C24 | H54 | 180.0° | 180.0° |
| C26 | C25 | C24 | C23 | 1.2° | 0.0° |
| C25 | C26 | C21 | H51 | 178.5° | 179.7° |
| C26 | C25 | C24 | H53 | 178.7° | 180.0° |
| C22 | C27 | C3 | H57 | 120.4° | 120.0° |
| C22 | C27 | C3 | H56 | 120.4° | 120.0° |
| C22 | C27 | C3 | N4 | 176.6° | 65.0° |
| C22 | C27 | C3 | C5 | 58.3° | 175.0° |
| C27 | C22 | C23 | C24 | 166.5° | 180.0° |
| C27 | C22 | C21 | H51 | 13.4° | 0.3° |
| C27 | C22 | C23 | H52 | 13.5° | 0.0° |
| C22 | C27 | H57 | H56 | 118.8° | 120.0° |
| C22 | C27 | C3 | H42 | 58.8° | 55.0° |
| C3 | C27 | C22 | C23 | 51.6° | 90.0° |
| C27 | C3 | N4 | C5 | 125.6° | 120.0° |
| C27 | C3 | N4 | H42 | 117.2° | 120.0° |
| C27 | C3 | N4 | C28 | 152.1° | 84.9° |
| C27 | C3 | C5 | H42 | 116.9° | 120.0° |
| C27 | C3 | C5 | N9 | 113.6° | 55.0° |
| C3 | C27 | H57 | H56 | 118.8° | 120.0° |
| C27 | C3 | N4 | H43 | 27.9° | 94.9° |
| C7 | C8 | N9 | C5 | 0.4° | 0.4° |
| C7 | C8 | N9 | C11 | 177.9° | 179.8° |
| C7 | C8 | C11 | C12 | 28.3° | 145.1° |
| C7 | C8 | C11 | C14 | 149.6° | 35.0° |
| C8 | C7 | N6 | H44 | 179.3° | 180.0° |
| C30 | C1 | N2 | H40 | 120.5° | 119.9° |
| C30 | C1 | N2 | H39 | 120.5° | 120.1° |
| C1 | C30 | C35 | C34 | 175.1° | 180.0° |
| C30 | C1 | N2 | C28 | 165.8° | 180.0° |
| C30 | C1 | H40 | H39 | 118.5° | 120.1° |
| C30 | C1 | N2 | H41 | 14.2° | 0.1° |
| C1 | C30 | C35 | H60 | 4.9° | 0.0° |
| C35 | C30 | C1 | N2 | 107.6° | 100.0° |
| C30 | C35 | C34 | C33 | 0.9° | 0.3° |
| C30 | C35 | C34 | H60 | 180.0° | 180.0° |
| C30 | C35 | C34 | CL1 | 176.8° | 180.0° |
| C35 | C30 | C1 | H40 | 12.9° | 140.0° |
| C35 | C30 | C1 | H39 | 131.9° | 20.0° |
| C1 | N2 | C28 | N4 | 46.4° | 179.9° |
| C1 | N2 | C28 | H41 | 180.0° | 179.9° |
| C1 | N2 | C28 | O29 | 137.7° | 0.0° |
| N2 | C1 | H40 | H39 | 118.4° | 120.0° |
| C33 | C34 | C35 | CL1 | 177.7° | 179.7° |
| C34 | C33 | C32 | H58 | 179.1° | 180.0° |
| C33 | C34 | C35 | H60 | 179.1° | 179.7° |
| C22 | C23 | C24 | C25 | 1.5° | 0.0° |
| C22 | C23 | C24 | H52 | 180.0° | 180.0° |
| C23 | C22 | C21 | H51 | 175.9° | 179.7° |
| C22 | C23 | C24 | H53 | 178.5° | 180.0° |
| C23 | C22 | C27 | H57 | 172.0° | 30.0° |
| C23 | C22 | C27 | H56 | 68.8° | 150.0° |
| C3 | N4 | C28 | H43 | 180.0° | 179.9° |
| N4 | C3 | C5 | H42 | 117.5° | 119.9° |
| N4 | C3 | C5 | N9 | 120.8° | 175.0° |
| C3 | N4 | C28 | N2 | 179.0° | 180.0° |
| C3 | N4 | C28 | O29 | 5.0° | 0.1° |
| N4 | C3 | C27 | H57 | 63.0° | 175.0° |
| N4 | C3 | C27 | H56 | 56.2° | 55.0° |
| C28 | N4 | C3 | C5 | 82.3° | 155.0° |
| N4 | C28 | N2 | O29 | 175.9° | 180.0° |
| N4 | C28 | N2 | H41 | 133.6° | 0.0° |
| C28 | N4 | C3 | H42 | 34.9° | 35.1° |
| C3 | C5 | N9 | C8 | 176.7° | 179.8° |
| C5 | C3 | C27 | H57 | 62.1° | 55.0° |
| C5 | C3 | C27 | H56 | 178.7° | 65.0° |
| C5 | C3 | N4 | H43 | 97.7° | 25.1° |
| C3 | C5 | N6 | H44 | 3.5° | 0.0° |
| C5 | N9 | C8 | C11 | 177.6° | 179.8° |
| N9 | C5 | C3 | H42 | 3.2° | 65.0° |
| N9 | C5 | N6 | H44 | 179.0° | 179.7° |
| C35 | C34 | C33 | H59 | 179.1° | 179.8° |
| CL1 | C34 | C33 | H59 | 3.2° | 0.1° |
| CL1 | C34 | C35 | H60 | 3.1° | 0.0° |
| C28 | N2 | C1 | H40 | 45.3° | 60.0° |
| C28 | N2 | C1 | H39 | 73.6° | 59.9° |
| N2 | C28 | N4 | H43 | 1.0° | 0.1° |
| C25 | C24 | C23 | H53 | 180.0° | 180.0° |
| C25 | C24 | C23 | H52 | 178.5° | 180.0° |
| C24 | C25 | C26 | H55 | 178.7° | 179.9° |
| N9 | C8 | C11 | C12 | 154.3° | 34.7° |
| N9 | C8 | C11 | C14 | 27.8° | 145.2° |
| C8 | C11 | C12 | C14 | 177.9° | 179.9° |
| C8 | C11 | C12 | C16 | 175.2° | 179.7° |
| C8 | C11 | C14 | C13 | 176.8° | 180.0° |
| C8 | C11 | C12 | H45 | 4.8° | 0.1° |
| C8 | C11 | C14 | H47 | 3.2° | 0.0° |
| O29 | C28 | N2 | H41 | 42.3° | 180.0° |
| O29 | C28 | N4 | H43 | 174.9° | 179.9° |
| C23 | C24 | C25 | H54 | 178.8° | 180.0° |
| C11 | C12 | C16 | H45 | 180.0° | 179.7° |
| C11 | C12 | C16 | N17 | 173.3° | 179.7° |
| C11 | C12 | C16 | C15 | 1.8° | 0.3° |
| C12 | C11 | C14 | C13 | 1.1° | 0.1° |
| C12 | C11 | C14 | H47 | 178.9° | 179.9° |
| C16 | C12 | C11 | C14 | 2.7° | 0.4° |
| C12 | C16 | N17 | C15 | 175.7° | 180.0° |
| C12 | C16 | N17 | N18 | 174.9° | 179.9° |
| C12 | C16 | C15 | C13 | 0.6° | 0.0° |
| C12 | C16 | C15 | C19 | 175.8° | 180.0° |
| C12 | C16 | N17 | H48 | 5.1° | 0.0° |
| C11 | C14 | C13 | H47 | 180.0° | 180.0° |
| C11 | C14 | C13 | C15 | 1.4° | 0.3° |
| C11 | C14 | C13 | H46 | 178.7° | 180.0° |
| C14 | C11 | C12 | H45 | 177.4° | 180.0° |
| C16 | N17 | N18 | H48 | 180.0° | 180.0° |
| C16 | N17 | N18 | C19 | 0.8° | 0.0° |
| N17 | C16 | C15 | C13 | 176.8° | 180.0° |
| N17 | C16 | C15 | C19 | 0.4° | 0.0° |
| N17 | C16 | C12 | H45 | 6.7° | 0.0° |
| N18 | N17 | C16 | C15 | 0.8° | 0.0° |
| N17 | N18 | C19 | C15 | 0.5° | 0.0° |
| N17 | N18 | C19 | N20 | 177.0° | 180.0° |
| C16 | C15 | C13 | C14 | 2.2° | 0.3° |
| C16 | C15 | C19 | N18 | 0.1° | 0.0° |
| C16 | C15 | C13 | C19 | 174.7° | 180.0° |
| C16 | C15 | C19 | N20 | 177.3° | 180.0° |
| C16 | C15 | C13 | H46 | 177.9° | 180.0° |
| C15 | C16 | C12 | H45 | 178.2° | 180.0° |
| C15 | C16 | N17 | H48 | 179.2° | 180.0° |
| C14 | C13 | C15 | H46 | 180.0° | 179.7° |
| C14 | C13 | C15 | C19 | 172.6° | 179.7° |
| N18 | C19 | C15 | C13 | 175.2° | 180.0° |
| N18 | C19 | C15 | N20 | 177.3° | 180.0° |
| C19 | N18 | N17 | H48 | 179.2° | 180.0° |
| N18 | C19 | N20 | H49 | 0.0° | 180.0° |
| N18 | C19 | N20 | H50 | 120.0° | 0.0° |
| C13 | C15 | C19 | N20 | 7.5° | 0.0° |
| C15 | C13 | C14 | H47 | 178.6° | 179.7° |
| C19 | C15 | C13 | H46 | 7.4° | 0.0° |
| C15 | C19 | N20 | H49 | 177.0° | 0.0° |
| C15 | C19 | N20 | H50 | 57.1° | 180.0° |
| C19 | N20 | H49 | H50 | 120.0° | 180.0° |
| H46 | C13 | C14 | H47 | 1.3° | 0.0° |
| H51 | C21 | C26 | H55 | 1.5° | 0.4° |
| H52 | C23 | C24 | H53 | 1.5° | 0.0° |
| H53 | C24 | C25 | H54 | 1.3° | 0.1° |
| H57 | C27 | C3 | H42 | 179.2° | 65.0° |
| H56 | C27 | C3 | H42 | 61.6° | 175.0° |
| H59 | C33 | C32 | H58 | 0.9° | 0.1° |
| H40 | C1 | N2 | H41 | 134.7° | 120.0° |
| H39 | C1 | N2 | H41 | 106.4° | 120.0° |
| H42 | C3 | N4 | H43 | 145.1° | 145.1° |
| H54 | C25 | C26 | H55 | 1.3° | 0.0° |
| H62 | C37 | N38 | H64 | 59.4° | 63.9° |
| H62 | C37 | N38 | H63 | 60.6° | 60.0° |
| H61 | C37 | N38 | H64 | 59.4° | 176.1° |
| H61 | C37 | N38 | H63 | 179.4° | 60.0° |
