PRD_001183
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | C24 | sing | 1.53Å | 1.55Å | |
| C24 | C25 | sing | 1.53Å | 1.55Å | |
| C24 | C23 | sing | 1.53Å | 1.54Å | |
| C31 | C29 | sing | 1.53Å | 1.55Å | |
| C30 | C29 | sing | 1.53Å | 1.56Å | |
| C23 | C2 | sing | 1.53Å | 1.54Å | |
| C29 | C28 | sing | 1.53Å | 1.56Å | |
| C28 | C27 | sing | 1.53Å | 1.55Å | |
| C2 | C21 | sing | 1.51Å | 1.51Å | |
| C2 | N | sing | 1.47Å | 1.46Å | |
| C21 | O1 | doub | 1.21Å | 1.23Å | |
| C21 | N21 | sing | 1.35Å | 1.35Å | |
| N21 | C27 | sing | 1.46Å | 1.46Å | |
| N | P | sing | 1.68Å | 1.81Å | |
| P | O2 | doub | 1.48Å | 1.49Å | |
| P | O3 | sing | 1.61Å | 1.50Å | |
| P | C22 | sing | 1.82Å | 1.83Å | |
| C22 | N2 | sing | 1.47Å | 1.45Å | |
| N2 | C3 | sing | 1.35Å | 1.35Å | |
| O21 | C3 | doub | 1.22Å | 1.23Å | |
| C3 | O4 | sing | 1.35Å | 1.34Å | |
| O4 | C4 | sing | 1.45Å | 1.44Å | |
| C6 | C7 | doub | 1.38Å | 1.40Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.40Å | Aromatic |
| C4 | C5 | sing | 1.51Å | 1.54Å | |
| C7 | C8 | sing | 1.38Å | 1.40Å | Aromatic |
| C5 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.40Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.40Å | Aromatic |
| N | H1 | sing | 1.01Å | 1.00Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C23 | H3 | sing | 1.09Å | 1.10Å | |
| C23 | H4 | sing | 1.09Å | 1.10Å | |
| C24 | H5 | sing | 1.09Å | 1.10Å | |
| C25 | H6 | sing | 1.09Å | 1.10Å | |
| C25 | H7 | sing | 1.09Å | 1.10Å | |
| C25 | H8 | sing | 1.09Å | 1.10Å | |
| C26 | H9 | sing | 1.09Å | 1.10Å | |
| C26 | H10 | sing | 1.09Å | 1.10Å | |
| C26 | H11 | sing | 1.09Å | 1.10Å | |
| N21 | H12 | sing | 0.97Å | 1.00Å | |
| O3 | H13 | sing | 0.97Å | 0.95Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C4 | H16 | sing | 1.09Å | 1.10Å | |
| C4 | H17 | sing | 1.09Å | 1.10Å | |
| C6 | H18 | sing | 1.08Å | 1.08Å | |
| C7 | H19 | sing | 1.08Å | 1.08Å | |
| C8 | H20 | sing | 1.08Å | 1.08Å | |
| C9 | H21 | sing | 1.08Å | 1.08Å | |
| C10 | H22 | sing | 1.08Å | 1.08Å | |
| N2 | H23 | sing | 0.97Å | 1.00Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| C28 | H26 | sing | 1.09Å | 1.10Å | |
| C28 | H27 | sing | 1.09Å | 1.10Å | |
| C29 | H28 | sing | 1.09Å | 1.10Å | |
| C30 | H29 | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H32 | sing | 1.09Å | 1.10Å | |
| C31 | H33 | sing | 1.09Å | 1.10Å | |
| C31 | H34 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C26 | C24 | C25 | 111.5° | 109.5° |
| C26 | C24 | C23 | 109.9° | 109.5° |
| C26 | C24 | H5 | 107.8° | 109.5° |
| C24 | C26 | H9 | 109.5° | 109.5° |
| C24 | C26 | H10 | 109.5° | 109.5° |
| C24 | C26 | H11 | 109.4° | 109.5° |
| C25 | C24 | C23 | 111.8° | 109.5° |
| C25 | C24 | H5 | 107.8° | 109.5° |
| C24 | C25 | H6 | 109.5° | 109.5° |
| C24 | C25 | H7 | 109.5° | 109.5° |
| C24 | C25 | H8 | 109.5° | 109.5° |
| C24 | C23 | C2 | 114.6° | 109.5° |
| C24 | C23 | H3 | 108.2° | 109.5° |
| C24 | C23 | H4 | 108.2° | 109.5° |
| C23 | C24 | H5 | 107.9° | 109.5° |
| C31 | C29 | C30 | 109.7° | 109.4° |
| C31 | C29 | C28 | 109.7° | 109.5° |
| C31 | C29 | H28 | 108.2° | 109.5° |
| C29 | C31 | H32 | 109.5° | 109.5° |
| C29 | C31 | H33 | 109.5° | 109.4° |
| C29 | C31 | H34 | 109.5° | 109.4° |
| C30 | C29 | C28 | 112.8° | 109.5° |
| C30 | C29 | H28 | 108.2° | 109.5° |
| C29 | C30 | H29 | 109.5° | 109.5° |
| C29 | C30 | H30 | 109.5° | 109.5° |
| C29 | C30 | H31 | 109.5° | 109.5° |
| C23 | C2 | C21 | 109.9° | 109.4° |
| C23 | C2 | N | 103.6° | 109.5° |
| C23 | C2 | H2 | 109.7° | 109.5° |
| C2 | C23 | H3 | 108.2° | 109.4° |
| C2 | C23 | H4 | 108.2° | 109.5° |
| C29 | C28 | C27 | 114.3° | 109.5° |
| C29 | C28 | H26 | 108.3° | 109.5° |
| C29 | C28 | H27 | 108.2° | 109.5° |
| C28 | C29 | H28 | 108.1° | 109.5° |
| C28 | C27 | N21 | 109.5° | 109.5° |
| C28 | C27 | H24 | 109.5° | 109.4° |
| C28 | C27 | H25 | 109.5° | 109.5° |
| C27 | C28 | H26 | 108.2° | 109.4° |
| C27 | C28 | H27 | 108.3° | 109.5° |
| C21 | C2 | N | 112.4° | 109.5° |
| C2 | C21 | O1 | 119.5° | 120.0° |
| C2 | C21 | N21 | 116.9° | 120.0° |
| C21 | C2 | H2 | 110.2° | 109.4° |
| C2 | N | P | 115.7° | 111.0° |
| C2 | N | H1 | 107.9° | 111.0° |
| N | C2 | H2 | 110.9° | 109.5° |
| O1 | C21 | N21 | 123.6° | 120.0° |
| C21 | N21 | C27 | 120.5° | 120.0° |
| C21 | N21 | H12 | 119.8° | 120.0° |
| C27 | N21 | H12 | 119.7° | 120.0° |
| N21 | C27 | H24 | 109.5° | 109.5° |
| N21 | C27 | H25 | 109.4° | 109.5° |
| N | P | O2 | 111.9° | 109.5° |
| N | P | O3 | 109.7° | 109.5° |
| N | P | C22 | 100.5° | 109.5° |
| P | N | H1 | 107.9° | 111.0° |
| O2 | P | O3 | 113.5° | 109.5° |
| O2 | P | C22 | 110.5° | 109.5° |
| O3 | P | C22 | 110.1° | 109.5° |
| P | O3 | H13 | 109.5° | 114.0° |
| P | C22 | N2 | 107.4° | 109.5° |
| P | C22 | H14 | 110.0° | 109.5° |
| P | C22 | H15 | 110.0° | 109.5° |
| C22 | N2 | C3 | 120.9° | 120.0° |
| N2 | C22 | H14 | 110.0° | 109.5° |
| N2 | C22 | H15 | 110.0° | 109.4° |
| C22 | N2 | H23 | 119.5° | 120.0° |
| N2 | C3 | O21 | 123.2° | 120.0° |
| N2 | C3 | O4 | 120.2° | 120.0° |
| C3 | N2 | H23 | 119.6° | 120.0° |
| O21 | C3 | O4 | 116.1° | 120.0° |
| C3 | O4 | C4 | 119.5° | 117.0° |
| O4 | C4 | C5 | 111.3° | 109.5° |
| O4 | C4 | H16 | 109.0° | 109.5° |
| O4 | C4 | H17 | 109.0° | 109.5° |
| C7 | C6 | C5 | 120.4° | 120.0° |
| C6 | C7 | C8 | 120.4° | 120.0° |
| C7 | C6 | H18 | 119.8° | 120.0° |
| C6 | C7 | H19 | 119.8° | 120.1° |
| C6 | C5 | C4 | 120.5° | 120.0° |
| C6 | C5 | C10 | 119.2° | 120.0° |
| C5 | C6 | H18 | 119.8° | 120.0° |
| C4 | C5 | C10 | 120.2° | 120.0° |
| C5 | C4 | H16 | 109.0° | 109.5° |
| C5 | C4 | H17 | 109.0° | 109.4° |
| C7 | C8 | C9 | 119.3° | 120.0° |
| C8 | C7 | H19 | 119.8° | 119.9° |
| C7 | C8 | H20 | 120.4° | 120.0° |
| C5 | C10 | C9 | 120.5° | 120.0° |
| C5 | C10 | H22 | 119.7° | 120.0° |
| C8 | C9 | C10 | 120.2° | 120.0° |
| C9 | C8 | H20 | 120.3° | 120.0° |
| C8 | C9 | H21 | 119.9° | 120.0° |
| C10 | C9 | H21 | 119.9° | 120.0° |
| C9 | C10 | H22 | 119.8° | 120.0° |
| H3 | C23 | H4 | 109.5° | 109.5° |
| H6 | C25 | H7 | 109.4° | 109.4° |
| H6 | C25 | H8 | 109.5° | 109.5° |
| H7 | C25 | H8 | 109.5° | 109.5° |
| H9 | C26 | H10 | 109.4° | 109.5° |
| H9 | C26 | H11 | 109.5° | 109.4° |
| H10 | C26 | H11 | 109.5° | 109.5° |
| H14 | C22 | H15 | 109.5° | 109.5° |
| H16 | C4 | H17 | 109.5° | 109.5° |
| H24 | C27 | H25 | 109.5° | 109.4° |
| H26 | C28 | H27 | 109.5° | 109.5° |
| H29 | C30 | H30 | 109.5° | 109.5° |
| H29 | C30 | H31 | 109.4° | 109.5° |
| H30 | C30 | H31 | 109.5° | 109.4° |
| H32 | C31 | H33 | 109.4° | 109.5° |
| H32 | C31 | H34 | 109.5° | 109.5° |
| H33 | C31 | H34 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C26 | C24 | C25 | C23 | 123.5° | 120.0° |
| C26 | C24 | C25 | H5 | 118.1° | 120.0° |
| C26 | C24 | C23 | H5 | 117.3° | 120.0° |
| C26 | C24 | C23 | C2 | 165.1° | 173.1° |
| C26 | C24 | C23 | H3 | 44.3° | 67.0° |
| C26 | C24 | C23 | H4 | 74.2° | 53.0° |
| C26 | C24 | C25 | H6 | 180.0° | 64.2° |
| C26 | C24 | C25 | H7 | 60.0° | 175.8° |
| C26 | C24 | C25 | H8 | 60.0° | 55.8° |
| C24 | C26 | H9 | H10 | 120.0° | 120.1° |
| C24 | C26 | H9 | H11 | 120.0° | 120.0° |
| C24 | C26 | H10 | H11 | 120.0° | 120.0° |
| C25 | C24 | C23 | H5 | 118.3° | 120.0° |
| C25 | C24 | C23 | C2 | 70.5° | 67.0° |
| C25 | C24 | C23 | H3 | 168.8° | 53.0° |
| C25 | C24 | C23 | H4 | 50.3° | 173.0° |
| C24 | C25 | H6 | H7 | 120.0° | 119.9° |
| C24 | C25 | H6 | H8 | 120.0° | 120.1° |
| C24 | C25 | H7 | H8 | 120.0° | 120.1° |
| C25 | C24 | C26 | H9 | 180.0° | 59.9° |
| C25 | C24 | C26 | H10 | 60.0° | 180.0° |
| C25 | C24 | C26 | H11 | 60.0° | 60.0° |
| C24 | C23 | C2 | H3 | 120.8° | 120.0° |
| C24 | C23 | C2 | H4 | 120.7° | 120.0° |
| C24 | C23 | C2 | C21 | 63.4° | 65.6° |
| C24 | C23 | C2 | N | 176.3° | 174.4° |
| C24 | C23 | C2 | H2 | 57.8° | 54.4° |
| C24 | C23 | H3 | H4 | 117.6° | 120.0° |
| C23 | C24 | C25 | H6 | 56.4° | 175.8° |
| C23 | C24 | C25 | H7 | 63.5° | 55.9° |
| C23 | C24 | C25 | H8 | 176.5° | 64.2° |
| C23 | C24 | C26 | H9 | 55.4° | 60.0° |
| C23 | C24 | C26 | H10 | 175.4° | 60.0° |
| C23 | C24 | C26 | H11 | 64.6° | 180.0° |
| C31 | C29 | C30 | C28 | 122.6° | 120.0° |
| C31 | C29 | C30 | H28 | 117.8° | 120.0° |
| C31 | C29 | C28 | H28 | 117.8° | 120.0° |
| C31 | C29 | C28 | C27 | 88.9° | 175.0° |
| C31 | C29 | C28 | H26 | 31.8° | 65.0° |
| C31 | C29 | C28 | H27 | 150.4° | 55.0° |
| C31 | C29 | C30 | H29 | 180.0° | 60.0° |
| C31 | C29 | C30 | H30 | 60.0° | 180.0° |
| C31 | C29 | C30 | H31 | 60.0° | 60.0° |
| C29 | C31 | H32 | H33 | 120.0° | 120.0° |
| C29 | C31 | H32 | H34 | 120.0° | 119.9° |
| C29 | C31 | H33 | H34 | 120.0° | 120.0° |
| C30 | C29 | C28 | H28 | 119.6° | 120.0° |
| C30 | C29 | C28 | C27 | 148.5° | 65.0° |
| C30 | C29 | C28 | H26 | 90.8° | 55.0° |
| C30 | C29 | C28 | H27 | 27.8° | 175.0° |
| C29 | C30 | H29 | H30 | 120.0° | 120.0° |
| C29 | C30 | H29 | H31 | 120.0° | 120.1° |
| C29 | C30 | H30 | H31 | 120.0° | 120.0° |
| C30 | C29 | C31 | H32 | 180.0° | 60.0° |
| C30 | C29 | C31 | H33 | 60.0° | 60.0° |
| C30 | C29 | C31 | H34 | 60.0° | 180.0° |
| C23 | C2 | C21 | N | 114.8° | 120.0° |
| C23 | C2 | C21 | H2 | 121.0° | 120.0° |
| C23 | C2 | N | H2 | 117.6° | 120.0° |
| C23 | C2 | C21 | O1 | 92.8° | 106.0° |
| C23 | C2 | C21 | N21 | 86.4° | 74.0° |
| C23 | C2 | N | P | 161.8° | 94.9° |
| C23 | C2 | N | H1 | 77.3° | 141.1° |
| C2 | C23 | H3 | H4 | 117.7° | 120.0° |
| C2 | C23 | C24 | H5 | 47.8° | 53.0° |
| C29 | C28 | C27 | H26 | 120.7° | 120.0° |
| C29 | C28 | C27 | H27 | 120.7° | 120.0° |
| C29 | C28 | C27 | N21 | 71.3° | 180.0° |
| C29 | C28 | C27 | H24 | 168.7° | 60.0° |
| C29 | C28 | C27 | H25 | 48.7° | 60.0° |
| C29 | C28 | H26 | H27 | 117.8° | 120.0° |
| C28 | C29 | C30 | H29 | 57.4° | 60.0° |
| C28 | C29 | C30 | H30 | 62.7° | 60.0° |
| C28 | C29 | C30 | H31 | 177.3° | 180.0° |
| C28 | C29 | C31 | H32 | 55.5° | 60.0° |
| C28 | C29 | C31 | H33 | 175.5° | 180.0° |
| C28 | C29 | C31 | H34 | 64.5° | 60.0° |
| C28 | C27 | N21 | C21 | 83.0° | 180.0° |
| C28 | C27 | N21 | H24 | 120.0° | 120.0° |
| C28 | C27 | N21 | H25 | 120.0° | 120.1° |
| C28 | C27 | N21 | H12 | 97.0° | 0.1° |
| C28 | C27 | H24 | H25 | 120.0° | 120.0° |
| C27 | C28 | H26 | H27 | 117.8° | 119.9° |
| C27 | C28 | C29 | H28 | 28.9° | 55.0° |
| C21 | C2 | N | H2 | 123.8° | 120.0° |
| C2 | C21 | O1 | N21 | 179.1° | 179.9° |
| C2 | C21 | N21 | C27 | 179.9° | 175.1° |
| C21 | C2 | N | P | 79.7° | 145.1° |
| C21 | C2 | N | H1 | 41.2° | 21.1° |
| C21 | C2 | C23 | H3 | 57.4° | 174.4° |
| C21 | C2 | C23 | H4 | 175.9° | 54.4° |
| C2 | C21 | N21 | H12 | 0.1° | 5.1° |
| N | C2 | C21 | O1 | 152.4° | 14.0° |
| N | C2 | C21 | N21 | 28.4° | 166.0° |
| C2 | N | P | H1 | 120.9° | 123.9° |
| C2 | N | P | O2 | 112.0° | 64.9° |
| C2 | N | P | O3 | 14.8° | 55.2° |
| C2 | N | P | C22 | 130.8° | 175.1° |
| N | C2 | C23 | H3 | 63.0° | 54.4° |
| N | C2 | C23 | H4 | 55.6° | 65.6° |
| O1 | C21 | N21 | C27 | 0.8° | 4.9° |
| O1 | C21 | C2 | H2 | 28.2° | 134.0° |
| O1 | C21 | N21 | H12 | 179.3° | 175.0° |
| C21 | N21 | C27 | H12 | 180.0° | 179.9° |
| N21 | C21 | C2 | H2 | 152.7° | 45.9° |
| C21 | N21 | C27 | H24 | 37.0° | 60.0° |
| C21 | N21 | C27 | H25 | 157.0° | 59.9° |
| N21 | C27 | H24 | H25 | 120.0° | 120.0° |
| N21 | C27 | C28 | H26 | 49.4° | 60.0° |
| N21 | C27 | C28 | H27 | 168.0° | 59.9° |
| N | P | O2 | O3 | 124.7° | 120.0° |
| N | P | O2 | C22 | 111.0° | 120.0° |
| N | P | O3 | C22 | 109.7° | 120.0° |
| N | P | C22 | N2 | 175.6° | 180.0° |
| P | N | C2 | H2 | 44.2° | 25.1° |
| N | P | O3 | H13 | 125.9° | 60.0° |
| N | P | C22 | H14 | 55.9° | 60.0° |
| N | P | C22 | H15 | 64.7° | 60.0° |
| O2 | P | O3 | C22 | 124.4° | 120.0° |
| O2 | P | C22 | N2 | 66.2° | 60.0° |
| O2 | P | N | H1 | 127.1° | 171.2° |
| O2 | P | O3 | H13 | 0.0° | 180.0° |
| O2 | P | C22 | H14 | 174.2° | 60.0° |
| O2 | P | C22 | H15 | 53.5° | 179.9° |
| O3 | P | C22 | N2 | 60.0° | 60.0° |
| O3 | P | N | H1 | 106.1° | 68.8° |
| O3 | P | C22 | H14 | 59.7° | 180.0° |
| O3 | P | C22 | H15 | 179.6° | 60.0° |
| P | C22 | N2 | H14 | 119.6° | 120.0° |
| P | C22 | N2 | H15 | 119.7° | 120.0° |
| P | C22 | N2 | C3 | 151.9° | 95.0° |
| C22 | P | N | H1 | 9.9° | 51.2° |
| C22 | P | O3 | H13 | 124.4° | 60.0° |
| P | C22 | H14 | H15 | 121.0° | 120.1° |
| P | C22 | N2 | H23 | 28.1° | 85.0° |
| C22 | N2 | C3 | H23 | 180.0° | 180.0° |
| C22 | N2 | C3 | O21 | 3.6° | 0.0° |
| C22 | N2 | C3 | O4 | 175.9° | 180.0° |
| N2 | C22 | H14 | H15 | 121.0° | 119.9° |
| N2 | C3 | O21 | O4 | 172.7° | 180.0° |
| N2 | C3 | O4 | C4 | 165.1° | 180.0° |
| C3 | N2 | C22 | H14 | 88.5° | 145.0° |
| C3 | N2 | C22 | H15 | 32.2° | 25.0° |
| O21 | C3 | O4 | C4 | 22.0° | 0.0° |
| O21 | C3 | N2 | H23 | 176.5° | 180.0° |
| C3 | O4 | C4 | C5 | 110.9° | 180.0° |
| C3 | O4 | C4 | H16 | 128.8° | 60.0° |
| C3 | O4 | C4 | H17 | 9.4° | 60.0° |
| O4 | C3 | N2 | H23 | 4.1° | 0.0° |
| O4 | C4 | C5 | C6 | 84.7° | 89.7° |
| O4 | C4 | C5 | H16 | 120.3° | 120.1° |
| O4 | C4 | C5 | H17 | 120.3° | 120.0° |
| O4 | C4 | C5 | C10 | 95.4° | 90.0° |
| O4 | C4 | H16 | H17 | 119.2° | 120.0° |
| C7 | C6 | C5 | H18 | 180.0° | 180.0° |
| C7 | C6 | C5 | C4 | 179.6° | 179.9° |
| C6 | C7 | C8 | H19 | 180.0° | 179.9° |
| C7 | C6 | C5 | C10 | 0.3° | 0.3° |
| C6 | C7 | C8 | C9 | 0.5° | 0.1° |
| C6 | C7 | C8 | H20 | 179.6° | 180.0° |
| C6 | C5 | C4 | C10 | 179.9° | 179.7° |
| C5 | C6 | C7 | C8 | 0.6° | 0.0° |
| C6 | C5 | C10 | C9 | 0.1° | 0.5° |
| C6 | C5 | C4 | H16 | 155.0° | 30.3° |
| C6 | C5 | C4 | H17 | 35.5° | 150.3° |
| C5 | C6 | C7 | H19 | 179.4° | 179.9° |
| C6 | C5 | C10 | H22 | 179.9° | 179.7° |
| C4 | C5 | C10 | C9 | 180.0° | 179.9° |
| C5 | C4 | H16 | H17 | 119.2° | 119.9° |
| C4 | C5 | C6 | H18 | 0.4° | 0.1° |
| C4 | C5 | C10 | H22 | 0.0° | 0.0° |
| C7 | C8 | C9 | H20 | 180.0° | 179.9° |
| C7 | C8 | C9 | C10 | 0.1° | 0.1° |
| C8 | C7 | C6 | H18 | 179.4° | 180.0° |
| C7 | C8 | C9 | H21 | 179.9° | 180.0° |
| C5 | C10 | C9 | C8 | 0.2° | 0.4° |
| C5 | C10 | C9 | H22 | 180.0° | 179.8° |
| C10 | C5 | C4 | H16 | 24.9° | 150.0° |
| C10 | C5 | C4 | H17 | 144.4° | 30.0° |
| C10 | C5 | C6 | H18 | 179.7° | 179.7° |
| C5 | C10 | C9 | H21 | 179.8° | 179.7° |
| C8 | C9 | C10 | H21 | 180.0° | 179.9° |
| C9 | C8 | C7 | H19 | 179.5° | 180.0° |
| C8 | C9 | C10 | H22 | 179.8° | 179.8° |
| C10 | C9 | C8 | H20 | 180.0° | 179.8° |
| H1 | N | C2 | H2 | 165.1° | 98.9° |
| H2 | C2 | C23 | H3 | 178.6° | 65.6° |
| H2 | C2 | C23 | H4 | 62.9° | 174.4° |
| H3 | C23 | C24 | H5 | 72.9° | 173.0° |
| H4 | C23 | C24 | H5 | 168.6° | 67.0° |
| H5 | C24 | C25 | H6 | 61.9° | 55.8° |
| H5 | C24 | C25 | H7 | 178.1° | 64.1° |
| H5 | C24 | C25 | H8 | 58.1° | 175.8° |
| H5 | C24 | C26 | H9 | 61.9° | 179.9° |
| H5 | C24 | C26 | H10 | 58.1° | 60.0° |
| H5 | C24 | C26 | H11 | 178.1° | 60.0° |
| H6 | C25 | H7 | H8 | 120.0° | 120.0° |
| H9 | C26 | H10 | H11 | 120.0° | 120.0° |
| H12 | N21 | C27 | H24 | 143.0° | 120.1° |
| H12 | N21 | C27 | H25 | 23.0° | 120.0° |
| H14 | C22 | N2 | H23 | 91.5° | 35.0° |
| H15 | C22 | N2 | H23 | 147.8° | 155.0° |
| H18 | C6 | C7 | H19 | 0.6° | 0.1° |
| H19 | C7 | C8 | H20 | 0.5° | 0.0° |
| H20 | C8 | C9 | H21 | 0.0° | 0.1° |
| H21 | C9 | C10 | H22 | 0.2° | 0.2° |
| H24 | C27 | C28 | H26 | 70.6° | NaN° |
| H24 | C27 | C28 | H27 | 48.0° | 60.0° |
| H25 | C27 | C28 | H26 | 169.4° | 60.0° |
| H25 | C27 | C28 | H27 | 72.0° | 180.0° |
| H26 | C28 | C29 | H28 | 149.6° | 175.0° |
| H27 | C28 | C29 | H28 | 91.8° | 65.0° |
| H28 | C29 | C30 | H29 | 62.2° | 180.0° |
| H28 | C29 | C30 | H30 | 177.8° | 60.0° |
| H28 | C29 | C30 | H31 | 57.8° | 60.0° |
| H28 | C29 | C31 | H32 | 62.2° | NaN° |
| H28 | C29 | C31 | H33 | 57.8° | 60.0° |
| H28 | C29 | C31 | H34 | 177.8° | 60.0° |
| H29 | C30 | H30 | H31 | 120.0° | 120.0° |
| H32 | C31 | H33 | H34 | 120.0° | 120.1° |
