R44
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O30 | C29 | doub | 1.21Å | 1.22Å | |
| C28 | C26 | sing | 1.55Å | 1.56Å | |
| C28 | C4 | sing | 1.52Å | 1.52Å | |
| C29 | C26 | sing | 1.51Å | 1.53Å | |
| C29 | N31 | sing | 1.35Å | 1.38Å | |
| C26 | O25 | sing | 1.44Å | 1.44Å | |
| C32 | N31 | sing | 1.47Å | 1.50Å | |
| C32 | C33 | sing | 1.53Å | 1.55Å | |
| N31 | C36 | sing | 1.47Å | 1.49Å | |
| C4 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | sing | 1.39Å | 1.40Å | Aromatic |
| C3 | C2 | sing | 1.39Å | 1.40Å | Aromatic |
| C36 | C35 | sing | 1.53Å | 1.54Å | |
| O25 | C5 | sing | 1.36Å | 1.35Å | |
| C5 | C6 | doub | 1.40Å | 1.42Å | Aromatic |
| C33 | N34 | sing | 1.47Å | 1.48Å | |
| C2 | CL1 | sing | 1.74Å | 1.73Å | |
| C2 | C7 | doub | 1.38Å | 1.38Å | Aromatic |
| C35 | N34 | sing | 1.47Å | 1.47Å | |
| C6 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | C8 | sing | 1.48Å | 1.49Å | |
| C8 | C9 | doub | 1.39Å | 1.41Å | Aromatic |
| C8 | C16 | sing | 1.41Å | 1.44Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | S15 | sing | 1.76Å | 1.76Å | Aromatic |
| C16 | C12 | doub | 1.40Å | 1.41Å | Aromatic |
| C10 | N11 | doub | 1.31Å | 1.32Å | Aromatic |
| S15 | C14 | sing | 1.75Å | 1.75Å | Aromatic |
| O24 | C23 | doub | 1.21Å | 1.21Å | |
| C22 | C23 | sing | 1.51Å | 1.51Å | |
| C22 | C21 | sing | 1.54Å | 1.54Å | |
| C12 | N11 | sing | 1.35Å | 1.36Å | Aromatic |
| C12 | C13 | sing | 1.45Å | 1.45Å | Aromatic |
| C23 | N18 | sing | 1.34Å | 1.34Å | |
| C14 | C13 | doub | 1.32Å | 1.31Å | Aromatic |
| C14 | C17 | sing | 1.51Å | 1.50Å | |
| C21 | C19 | sing | 1.51Å | 1.51Å | |
| N18 | C17 | sing | 1.46Å | 1.47Å | |
| N18 | C19 | sing | 1.34Å | 1.35Å | |
| C19 | O20 | doub | 1.21Å | 1.21Å | |
| C3 | H1 | sing | 1.08Å | 1.08Å | |
| C7 | H2 | sing | 1.08Å | 1.08Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C17 | H4 | sing | 1.09Å | 1.10Å | |
| C21 | H5 | sing | 1.09Å | 1.10Å | |
| C32 | H6 | sing | 1.09Å | 1.10Å | |
| C32 | H7 | sing | 1.09Å | 1.10Å | |
| C33 | H8 | sing | 1.09Å | 1.10Å | |
| C33 | H9 | sing | 1.09Å | 1.10Å | |
| C35 | H10 | sing | 1.09Å | 1.10Å | |
| C35 | H11 | sing | 1.09Å | 1.10Å | |
| C36 | H12 | sing | 1.09Å | 1.10Å | |
| C36 | H13 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.08Å | 1.08Å | |
| C10 | H15 | sing | 1.08Å | 1.08Å | |
| C13 | H16 | sing | 1.08Å | 1.08Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C26 | H18 | sing | 1.09Å | 1.10Å | |
| C28 | H19 | sing | 1.09Å | 1.10Å | |
| C28 | H20 | sing | 1.09Å | 1.10Å | |
| N34 | H21 | sing | 1.01Å | 1.00Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O30 | C29 | C26 | 119.5° | 120.0° |
| O30 | C29 | N31 | 119.6° | 120.0° |
| C26 | C28 | C4 | 103.7° | 102.0° |
| C28 | C26 | C29 | 118.7° | 110.9° |
| C28 | C26 | O25 | 102.1° | 102.8° |
| C28 | C26 | H18 | 108.6° | 110.8° |
| C26 | C28 | H19 | 110.9° | 111.0° |
| C26 | C28 | H20 | 110.9° | 111.0° |
| C28 | C4 | C3 | 132.0° | 132.1° |
| C28 | C4 | C5 | 107.3° | 107.0° |
| C4 | C28 | H19 | 110.9° | 110.9° |
| C4 | C28 | H20 | 110.9° | 110.9° |
| C26 | C29 | N31 | 120.9° | 120.0° |
| C29 | C26 | O25 | 108.1° | 110.7° |
| C29 | C26 | H18 | 108.9° | 110.7° |
| C29 | N31 | C32 | 124.3° | 120.9° |
| C29 | N31 | C36 | 124.3° | 120.9° |
| C26 | O25 | C5 | 112.7° | 109.2° |
| O25 | C26 | H18 | 110.1° | 110.8° |
| N31 | C32 | C33 | 109.0° | 108.5° |
| C32 | N31 | C36 | 111.4° | 118.2° |
| N31 | C32 | H6 | 109.6° | 109.6° |
| N31 | C32 | H7 | 109.6° | 109.7° |
| C32 | C33 | N34 | 111.7° | 109.3° |
| C33 | C32 | H6 | 109.6° | 109.6° |
| C33 | C32 | H7 | 109.6° | 109.7° |
| C32 | C33 | H8 | 108.9° | 109.5° |
| C32 | C33 | H9 | 108.9° | 109.5° |
| N31 | C36 | C35 | 104.0° | 108.5° |
| N31 | C36 | H12 | 110.8° | 109.6° |
| N31 | C36 | H13 | 110.8° | 109.8° |
| C3 | C4 | C5 | 120.6° | 120.8° |
| C4 | C3 | C2 | 119.7° | 120.3° |
| C4 | C3 | H1 | 120.2° | 119.9° |
| C4 | C5 | O25 | 110.6° | 111.2° |
| C4 | C5 | C6 | 119.7° | 118.8° |
| C3 | C2 | CL1 | 122.3° | 120.1° |
| C3 | C2 | C7 | 119.8° | 119.9° |
| C2 | C3 | H1 | 120.1° | 119.9° |
| C36 | C35 | N34 | 106.7° | 109.3° |
| C36 | C35 | H10 | 110.2° | 109.5° |
| C36 | C35 | H11 | 110.2° | 109.5° |
| C35 | C36 | H12 | 110.8° | 109.6° |
| C35 | C36 | H13 | 110.8° | 109.7° |
| O25 | C5 | C6 | 129.7° | 129.9° |
| C5 | C6 | C7 | 118.2° | 120.0° |
| C5 | C6 | C8 | 121.8° | 120.0° |
| C33 | N34 | C35 | 119.7° | 111.3° |
| N34 | C33 | H8 | 108.9° | 109.5° |
| N34 | C33 | H9 | 108.9° | 109.5° |
| C33 | N34 | H21 | 106.8° | 111.0° |
| CL1 | C2 | C7 | 118.0° | 120.0° |
| C2 | C7 | C6 | 122.0° | 120.2° |
| C2 | C7 | H2 | 119.0° | 119.9° |
| N34 | C35 | H10 | 110.2° | 109.5° |
| N34 | C35 | H11 | 110.1° | 109.5° |
| C35 | N34 | H21 | 106.9° | 111.0° |
| C7 | C6 | C8 | 120.0° | 120.0° |
| C6 | C7 | H2 | 119.0° | 119.9° |
| C6 | C8 | C9 | 120.0° | 120.8° |
| C6 | C8 | C16 | 122.6° | 120.8° |
| C9 | C8 | C16 | 117.4° | 118.4° |
| C8 | C9 | C10 | 119.5° | 119.0° |
| C8 | C9 | H14 | 120.2° | 120.5° |
| C8 | C16 | S15 | 132.0° | 130.7° |
| C8 | C16 | C12 | 119.5° | 119.4° |
| C9 | C10 | N11 | 121.9° | 121.5° |
| C10 | C9 | H14 | 120.2° | 120.5° |
| C9 | C10 | H15 | 119.1° | 119.2° |
| S15 | C16 | C12 | 108.5° | 109.9° |
| C16 | S15 | C14 | 93.2° | 92.1° |
| C16 | C12 | N11 | 119.8° | 119.3° |
| C16 | C12 | C13 | 112.0° | 111.8° |
| C10 | N11 | C12 | 121.8° | 122.4° |
| N11 | C10 | H15 | 119.0° | 119.2° |
| S15 | C14 | C13 | 111.0° | 111.3° |
| S15 | C14 | C17 | 124.8° | 124.4° |
| O24 | C23 | C22 | 123.9° | 125.3° |
| O24 | C23 | N18 | 126.9° | 125.5° |
| C23 | C22 | C21 | 104.1° | 103.6° |
| C22 | C23 | N18 | 109.1° | 109.2° |
| C23 | C22 | H17 | 110.8° | 110.6° |
| C23 | C22 | H23 | 110.8° | 110.7° |
| C22 | C21 | C19 | 103.4° | 103.6° |
| C22 | C21 | H5 | 110.9° | 110.7° |
| C21 | C22 | H17 | 110.8° | 110.6° |
| C22 | C21 | H22 | 111.0° | 110.8° |
| C21 | C22 | H23 | 110.8° | 110.5° |
| N11 | C12 | C13 | 128.3° | 129.0° |
| C12 | C13 | C14 | 115.4° | 114.9° |
| C12 | C13 | H16 | 122.3° | 122.5° |
| C23 | N18 | C17 | 122.2° | 122.7° |
| C23 | N18 | C19 | 113.8° | 114.5° |
| C13 | C14 | C17 | 124.2° | 124.3° |
| C14 | C13 | H16 | 122.3° | 122.5° |
| C14 | C17 | N18 | 108.4° | 109.5° |
| C14 | C17 | H3 | 109.7° | 109.5° |
| C14 | C17 | H4 | 109.7° | 109.5° |
| C21 | C19 | N18 | 109.6° | 109.2° |
| C21 | C19 | O20 | 122.9° | 125.4° |
| C19 | C21 | H5 | 111.0° | 110.6° |
| C19 | C21 | H22 | 110.9° | 110.6° |
| C17 | N18 | C19 | 124.0° | 122.8° |
| N18 | C17 | H3 | 109.7° | 109.5° |
| N18 | C17 | H4 | 109.7° | 109.5° |
| N18 | C19 | O20 | 127.6° | 125.4° |
| H3 | C17 | H4 | 109.5° | 109.4° |
| H5 | C21 | H22 | 109.5° | 110.5° |
| H6 | C32 | H7 | 109.5° | 109.7° |
| H8 | C33 | H9 | 109.4° | 109.5° |
| H10 | C35 | H11 | 109.4° | 109.5° |
| H12 | C36 | H13 | 109.5° | 109.6° |
| H17 | C22 | H23 | 109.5° | 110.7° |
| H19 | C28 | H20 | 109.5° | 110.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O30 | C29 | C26 | C28 | 7.3° | 109.9° |
| O30 | C29 | C26 | N31 | 179.4° | 180.0° |
| O30 | C29 | C26 | O25 | 122.8° | 3.5° |
| O30 | C29 | N31 | C32 | 1.6° | 0.0° |
| O30 | C29 | N31 | C36 | 179.1° | 179.9° |
| O30 | C29 | C26 | H18 | 117.5° | 126.8° |
| C26 | C28 | C4 | H19 | 119.0° | 118.2° |
| C26 | C28 | C4 | H20 | 119.1° | 118.2° |
| C28 | C26 | C29 | O25 | 115.5° | 113.4° |
| C28 | C26 | C29 | H18 | 124.8° | 123.4° |
| C28 | C26 | C29 | N31 | 173.3° | 70.2° |
| C28 | C26 | O25 | H18 | 115.2° | 118.3° |
| C26 | C28 | C4 | C3 | 169.1° | 164.3° |
| C26 | C28 | C4 | C5 | 10.6° | 15.1° |
| C28 | C26 | O25 | C5 | 19.1° | 27.9° |
| C26 | C28 | H19 | H20 | 122.7° | 123.8° |
| C4 | C28 | C26 | C29 | 101.6° | 143.6° |
| C4 | C28 | C26 | O25 | 17.0° | 25.2° |
| C28 | C4 | C3 | C5 | 179.6° | 179.4° |
| C28 | C4 | C3 | C2 | 179.7° | 179.1° |
| C28 | C4 | C5 | O25 | 0.7° | 1.4° |
| C28 | C4 | C5 | C6 | 179.9° | 179.0° |
| C28 | C4 | C3 | H1 | 0.3° | 0.9° |
| C4 | C28 | C26 | H18 | 133.3° | 93.1° |
| C4 | C28 | H19 | H20 | 122.7° | 123.7° |
| C29 | C26 | O25 | H18 | 118.9° | 123.2° |
| C26 | C29 | N31 | C32 | 179.0° | 180.0° |
| C26 | C29 | N31 | C36 | 1.5° | 0.1° |
| C29 | C26 | O25 | C5 | 106.8° | 146.3° |
| C29 | C26 | C28 | H19 | 139.3° | 25.4° |
| C29 | C26 | C28 | H20 | 17.4° | 98.3° |
| N31 | C29 | C26 | O25 | 57.8° | 176.4° |
| C29 | N31 | C32 | C36 | 177.8° | 179.9° |
| C29 | N31 | C32 | C33 | 116.9° | 128.7° |
| C29 | N31 | C36 | C35 | 105.2° | 128.8° |
| C29 | N31 | C32 | H6 | 3.0° | 9.0° |
| C29 | N31 | C32 | H7 | 123.1° | 111.5° |
| C29 | N31 | C36 | H12 | 135.7° | 111.5° |
| C29 | N31 | C36 | H13 | 13.9° | 8.9° |
| N31 | C29 | C26 | H18 | 61.8° | 53.2° |
| C26 | O25 | C5 | C4 | 13.3° | 19.4° |
| C26 | O25 | C5 | C6 | 167.4° | 161.2° |
| O25 | C26 | C28 | H19 | 102.0° | 92.9° |
| O25 | C26 | C28 | H20 | 136.1° | 143.4° |
| N31 | C32 | C33 | H6 | 119.9° | 119.7° |
| N31 | C32 | C33 | H7 | 119.9° | 119.8° |
| C32 | N31 | C36 | C35 | 72.6° | 51.2° |
| N31 | C32 | C33 | N34 | 41.4° | 53.9° |
| N31 | C32 | H6 | H7 | 120.2° | 120.5° |
| N31 | C32 | C33 | H8 | 79.0° | 173.8° |
| N31 | C32 | C33 | H9 | 161.8° | 66.1° |
| C32 | N31 | C36 | H12 | 46.5° | 68.5° |
| C32 | N31 | C36 | H13 | 168.3° | 171.0° |
| C33 | C32 | N31 | C36 | 60.9° | 51.2° |
| C32 | C33 | N34 | H8 | 120.4° | 120.0° |
| C32 | C33 | N34 | H9 | 120.3° | 120.0° |
| C32 | C33 | N34 | C35 | 41.3° | 63.1° |
| C33 | C32 | H6 | H7 | 120.2° | 120.5° |
| C32 | C33 | H8 | H9 | 118.9° | 120.1° |
| C32 | C33 | N34 | H21 | 162.7° | 61.0° |
| N31 | C36 | C35 | H12 | 119.1° | 119.7° |
| N31 | C36 | C35 | H13 | 119.1° | 119.9° |
| N31 | C36 | C35 | N34 | 63.7° | 53.8° |
| C36 | N31 | C32 | H6 | 179.2° | 170.9° |
| C36 | N31 | C32 | H7 | 59.1° | 68.6° |
| N31 | C36 | C35 | H10 | 176.7° | 66.2° |
| N31 | C36 | C35 | H11 | 55.9° | 173.8° |
| N31 | C36 | H12 | H13 | 122.5° | 120.5° |
| C4 | C3 | C2 | H1 | 180.0° | 180.0° |
| C3 | C4 | C5 | O25 | 179.5° | 179.0° |
| C3 | C4 | C5 | C6 | 0.1° | 0.5° |
| C4 | C3 | C2 | CL1 | 179.8° | 180.0° |
| C4 | C3 | C2 | C7 | 0.3° | 0.3° |
| C3 | C4 | C28 | H19 | 71.8° | 77.5° |
| C3 | C4 | C28 | H20 | 50.1° | 46.1° |
| C5 | C4 | C3 | C2 | 0.0° | 0.3° |
| C4 | C5 | O25 | C6 | 179.3° | 179.5° |
| C4 | C5 | C6 | C7 | 0.1° | 0.2° |
| C4 | C5 | C6 | C8 | 179.9° | 179.7° |
| C5 | C4 | C3 | H1 | 180.0° | 179.6° |
| C5 | C4 | C28 | H19 | 108.5° | 103.0° |
| C5 | C4 | C28 | H20 | 129.6° | 133.3° |
| C3 | C2 | CL1 | C7 | 179.9° | 179.7° |
| C3 | C2 | C7 | C6 | 0.6° | 0.6° |
| C3 | C2 | C7 | H2 | 179.5° | 179.5° |
| C36 | C35 | N34 | C33 | 52.6° | 63.1° |
| C36 | C35 | N34 | H10 | 119.6° | 120.0° |
| C36 | C35 | N34 | H11 | 119.6° | 120.0° |
| C36 | C35 | H10 | H11 | 121.3° | 120.1° |
| C35 | C36 | H12 | H13 | 122.5° | 120.4° |
| C36 | C35 | N34 | H21 | 174.0° | 61.1° |
| O25 | C5 | C6 | C7 | 179.2° | 179.3° |
| O25 | C5 | C6 | C8 | 0.7° | 0.8° |
| C5 | O25 | C26 | H18 | 134.3° | 90.4° |
| C5 | C6 | C7 | C2 | 0.4° | 0.4° |
| C5 | C6 | C7 | C8 | 179.9° | 179.9° |
| C5 | C6 | C8 | C9 | 49.8° | 115.0° |
| C5 | C6 | C8 | C16 | 129.4° | 65.4° |
| C5 | C6 | C7 | H2 | 179.6° | 179.8° |
| C33 | N34 | C35 | H21 | 121.4° | 124.2° |
| N34 | C33 | C32 | H6 | 161.3° | 173.5° |
| N34 | C33 | C32 | H7 | 78.5° | 65.9° |
| N34 | C33 | H8 | H9 | 119.0° | 120.0° |
| C33 | N34 | C35 | H10 | 172.2° | 56.9° |
| C33 | N34 | C35 | H11 | 67.0° | 176.9° |
| CL1 | C2 | C7 | C6 | 179.5° | 179.6° |
| CL1 | C2 | C3 | H1 | 0.2° | 0.0° |
| CL1 | C2 | C7 | H2 | 0.5° | 0.2° |
| C2 | C7 | C6 | H2 | 180.0° | 179.8° |
| C2 | C7 | C6 | C8 | 179.7° | 179.7° |
| C7 | C2 | C3 | H1 | 179.7° | 179.8° |
| C35 | N34 | C33 | H8 | 79.1° | 176.9° |
| C35 | N34 | C33 | H9 | 161.6° | 56.8° |
| N34 | C35 | H10 | H11 | 121.2° | 120.1° |
| N34 | C35 | C36 | H12 | 55.4° | 65.9° |
| N34 | C35 | C36 | H13 | 177.2° | 173.7° |
| C7 | C6 | C8 | C9 | 130.1° | 65.1° |
| C7 | C6 | C8 | C16 | 50.8° | 114.5° |
| C6 | C8 | C9 | C16 | 179.2° | 179.6° |
| C6 | C8 | C9 | C10 | 179.5° | 179.9° |
| C6 | C8 | C16 | S15 | 0.9° | 0.2° |
| C6 | C8 | C16 | C12 | 179.3° | 179.9° |
| C8 | C6 | C7 | H2 | 0.3° | 0.1° |
| C6 | C8 | C9 | H14 | 0.5° | 0.1° |
| C8 | C9 | C10 | H14 | 180.0° | 180.0° |
| C9 | C8 | C16 | S15 | 179.9° | 179.8° |
| C9 | C8 | C16 | C12 | 0.1° | 0.3° |
| C8 | C9 | C10 | N11 | 0.3° | 0.0° |
| C8 | C9 | C10 | H15 | 179.7° | 180.0° |
| C16 | C8 | C9 | C10 | 0.3° | 0.3° |
| C8 | C16 | S15 | C12 | 179.8° | 179.9° |
| C8 | C16 | S15 | C14 | 179.8° | 179.9° |
| C8 | C16 | C12 | N11 | 0.0° | 0.1° |
| C8 | C16 | C12 | C13 | 179.9° | 179.7° |
| C16 | C8 | C9 | H14 | 179.7° | 179.7° |
| C9 | C10 | N11 | H15 | 180.0° | 180.0° |
| C9 | C10 | N11 | C12 | 0.2° | 0.2° |
| S15 | C16 | C12 | N11 | 179.8° | 180.0° |
| S15 | C16 | C12 | C13 | 0.3° | 0.2° |
| C16 | S15 | C14 | C13 | 0.5° | 0.3° |
| C16 | S15 | C14 | C17 | 179.4° | 179.8° |
| C16 | C12 | N11 | C10 | 0.0° | 0.2° |
| C12 | C16 | S15 | C14 | 0.4° | 0.0° |
| C16 | C12 | N11 | C13 | 179.9° | 179.7° |
| C16 | C12 | C13 | C14 | 0.1° | 0.5° |
| C16 | C12 | C13 | H16 | 179.9° | 179.7° |
| C10 | N11 | C12 | C13 | 179.9° | 180.0° |
| N11 | C10 | C9 | H14 | 179.7° | 180.0° |
| S15 | C14 | C13 | C12 | 0.4° | 0.5° |
| S15 | C14 | C13 | C17 | 179.9° | 179.5° |
| S15 | C14 | C17 | N18 | 81.9° | 89.4° |
| S15 | C14 | C17 | H3 | 158.3° | 30.6° |
| S15 | C14 | C17 | H4 | 38.0° | 150.5° |
| S15 | C14 | C13 | H16 | 179.6° | 179.7° |
| O24 | C23 | C22 | N18 | 179.4° | 179.9° |
| O24 | C23 | C22 | C21 | 179.4° | 179.9° |
| O24 | C23 | N18 | C17 | 0.7° | 0.1° |
| O24 | C23 | N18 | C19 | 179.6° | 179.9° |
| O24 | C23 | C22 | H17 | 60.3° | 61.6° |
| O24 | C23 | C22 | H23 | 61.5° | 61.5° |
| C23 | C22 | C21 | H17 | 119.2° | 118.5° |
| C23 | C22 | C21 | H23 | 119.2° | 118.5° |
| C23 | C22 | C21 | C19 | 0.2° | 0.1° |
| C22 | C23 | N18 | C17 | 179.9° | 180.0° |
| C22 | C23 | N18 | C19 | 0.3° | 0.2° |
| C23 | C22 | C21 | H5 | 118.8° | 118.7° |
| C23 | C22 | H17 | H23 | 122.5° | 123.0° |
| C23 | C22 | C21 | H22 | 119.3° | 118.4° |
| C21 | C22 | C23 | N18 | 0.0° | 0.0° |
| C22 | C21 | C19 | H5 | 119.0° | 118.6° |
| C22 | C21 | C19 | H22 | 119.0° | 118.7° |
| C22 | C21 | C19 | N18 | 0.4° | 0.2° |
| C22 | C21 | C19 | O20 | 179.6° | 180.0° |
| C22 | C21 | H5 | H22 | 122.8° | 123.1° |
| C21 | C22 | H17 | H23 | 122.5° | 122.8° |
| N11 | C12 | C13 | C14 | 179.8° | 179.8° |
| C12 | N11 | C10 | H15 | 179.8° | 179.7° |
| N11 | C12 | C13 | H16 | 0.2° | 0.0° |
| C12 | C13 | C14 | H16 | 180.0° | 179.8° |
| C12 | C13 | C14 | C17 | 179.5° | 180.0° |
| C23 | N18 | C17 | C14 | 83.3° | 90.0° |
| C23 | N18 | C19 | C21 | 0.4° | 0.3° |
| C23 | N18 | C17 | C19 | 179.6° | 179.8° |
| C23 | N18 | C19 | O20 | 179.5° | 180.0° |
| C23 | N18 | C17 | H3 | 156.8° | 30.0° |
| C23 | N18 | C17 | H4 | 36.5° | 149.9° |
| N18 | C23 | C22 | H17 | 119.1° | 118.5° |
| N18 | C23 | C22 | H23 | 119.1° | 118.4° |
| C13 | C14 | C17 | N18 | 98.1° | 90.0° |
| C13 | C14 | C17 | H3 | 21.8° | 150.0° |
| C13 | C14 | C17 | H4 | 142.1° | 30.0° |
| C14 | C17 | N18 | H3 | 119.8° | 120.0° |
| C14 | C17 | N18 | H4 | 119.8° | 120.0° |
| C14 | C17 | N18 | C19 | 96.3° | 90.2° |
| C14 | C17 | H3 | H4 | 120.5° | 120.0° |
| C17 | C14 | C13 | H16 | 0.5° | 0.2° |
| C21 | C19 | N18 | C17 | 179.9° | 179.9° |
| C21 | C19 | N18 | O20 | 179.1° | 179.7° |
| C19 | C21 | H5 | H22 | 122.8° | 122.7° |
| C19 | C21 | C22 | H17 | 119.4° | 118.4° |
| C19 | C21 | C22 | H23 | 118.9° | 118.7° |
| C17 | N18 | C19 | O20 | 0.8° | 0.2° |
| N18 | C17 | H3 | H4 | 120.5° | 120.0° |
| C19 | N18 | C17 | H3 | 23.6° | 149.8° |
| C19 | N18 | C17 | H4 | 143.9° | 29.9° |
| N18 | C19 | C21 | H5 | 118.6° | 118.8° |
| N18 | C19 | C21 | H22 | 119.5° | 118.5° |
| O20 | C19 | C21 | H5 | 60.6° | 61.4° |
| O20 | C19 | C21 | H22 | 61.4° | 61.2° |
| H5 | C21 | C22 | H17 | 0.4° | 0.1° |
| H5 | C21 | C22 | H23 | 122.0° | 122.8° |
| H6 | C32 | C33 | H8 | 41.0° | 66.5° |
| H6 | C32 | C33 | H9 | 78.3° | 53.6° |
| H7 | C32 | C33 | H8 | 161.1° | 54.0° |
| H7 | C32 | C33 | H9 | 41.8° | 174.2° |
| H8 | C33 | N34 | H21 | 42.4° | 58.9° |
| H9 | C33 | N34 | H21 | 76.9° | 179.0° |
| H10 | C35 | C36 | H12 | 64.1° | 174.1° |
| H10 | C35 | C36 | H13 | 57.6° | 53.8° |
| H10 | C35 | N34 | H21 | 66.4° | 179.0° |
| H11 | C35 | C36 | H12 | 175.0° | 54.1° |
| H11 | C35 | C36 | H13 | 63.2° | 66.3° |
| H11 | C35 | N34 | H21 | 54.4° | 58.9° |
| H14 | C9 | C10 | H15 | 0.3° | 0.0° |
| H17 | C22 | C21 | H22 | 121.6° | 123.0° |
| H18 | C26 | C28 | H19 | 14.3° | 148.8° |
| H18 | C26 | C28 | H20 | 107.6° | 25.1° |
| H22 | C21 | C22 | H23 | 0.1° | 0.1° |
