SLD
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.39Å | 1.50Å | Aromatic |
| C1 | C3 | sing | 1.38Å | 1.47Å | Aromatic |
| C2 | N1 | sing | 1.40Å | 1.45Å | |
| C2 | C4 | sing | 1.39Å | 1.43Å | Aromatic |
| C3 | C12 | doub | 1.40Å | 1.46Å | Aromatic |
| N1 | C5 | sing | 1.47Å | 1.49Å | |
| N1 | C6 | sing | 1.34Å | 1.45Å | |
| C4 | C11 | doub | 1.38Å | 1.46Å | Aromatic |
| C5 | C7 | sing | 1.54Å | 1.54Å | |
| C6 | O1 | sing | 1.34Å | 1.40Å | |
| C6 | O3 | doub | 1.21Å | 1.19Å | |
| C7 | C8 | sing | 1.53Å | 1.52Å | |
| C7 | O1 | sing | 1.46Å | 1.41Å | |
| C8 | N2 | sing | 1.47Å | 1.47Å | |
| N2 | C9 | sing | 1.35Å | 1.36Å | |
| C9 | C10 | sing | 1.51Å | 1.50Å | |
| C9 | O2 | doub | 1.21Å | 1.26Å | |
| C11 | C12 | sing | 1.40Å | 1.53Å | Aromatic |
| C11 | F1 | sing | 1.35Å | 1.44Å | |
| C12 | C2B | sing | 1.48Å | 1.54Å | |
| C2B | C3B | doub | 1.33Å | 1.34Å | |
| C3B | C4B | sing | 1.51Å | 1.47Å | |
| C4B | C5B | sing | 1.53Å | 1.50Å | |
| C5B | CAS | sing | 1.53Å | 1.54Å | |
| CAS | N5S | sing | 1.46Å | 1.46Å | |
| N5S | C0S | sing | 1.35Å | 1.29Å | |
| C0S | C9S | sing | 1.51Å | 1.43Å | |
| C0S | O2S | doub | 1.21Å | 1.25Å | |
| C9S | C8S | sing | 1.51Å | 1.35Å | |
| C8S | C6S | doub | 1.36Å | 1.58Å | |
| C1S | O1S | doub | 1.22Å | 1.24Å | |
| C1S | N2S | sing | 1.35Å | 1.45Å | |
| C1S | C6S | sing | 1.48Å | 1.58Å | |
| N2S | C3S | sing | 1.34Å | 1.41Å | |
| C3S | O3S | doub | 1.22Å | 1.25Å | |
| C3S | N4S | sing | 1.34Å | 1.38Å | |
| N4S | C5S | doub | 1.31Å | 1.45Å | |
| C5S | C7S | sing | 1.51Å | 1.57Å | |
| C5S | C6S | sing | 1.47Å | 1.49Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| N2 | HN2 | sing | 0.97Å | 1.00Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C10 | H10B | sing | 1.09Å | 1.10Å | |
| C2B | H2B | sing | 1.08Å | 1.08Å | |
| C3B | H3B | sing | 1.08Å | 1.08Å | |
| C4B | H4B | sing | 1.09Å | 1.10Å | |
| C4B | H4BA | sing | 1.09Å | 1.10Å | |
| C5B | H5B | sing | 1.09Å | 1.10Å | |
| C5B | H5BA | sing | 1.09Å | 1.10Å | |
| CAS | HAS | sing | 1.09Å | 1.10Å | |
| CAS | HASA | sing | 1.09Å | 1.10Å | |
| N5S | HN5S | sing | 0.97Å | 1.00Å | |
| C9S | H9S | sing | 1.09Å | 1.10Å | |
| C9S | H9SA | sing | 1.09Å | 1.10Å | |
| C8S | H8S | sing | 1.08Å | 1.08Å | |
| N2S | HN2S | sing | 0.97Å | 1.00Å | |
| C7S | H7S | sing | 1.09Å | 1.10Å | |
| C7S | H7SA | sing | 1.09Å | 1.10Å | |
| C7S | H7SB | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C3 | 120.6° | 120.2° |
| C1 | C2 | N1 | 116.9° | 120.0° |
| C1 | C2 | C4 | 122.2° | 120.2° |
| C2 | C1 | H1 | 119.7° | 119.9° |
| C1 | C3 | C12 | 119.2° | 119.9° |
| C3 | C1 | H1 | 119.7° | 119.9° |
| C1 | C3 | H3 | 120.4° | 120.0° |
| N1 | C2 | C4 | 120.9° | 119.9° |
| C2 | N1 | C5 | 120.5° | 125.5° |
| C2 | N1 | C6 | 131.4° | 125.6° |
| C2 | C4 | C11 | 117.0° | 120.0° |
| C2 | C4 | H4 | 121.5° | 120.0° |
| C3 | C12 | C11 | 117.7° | 119.9° |
| C3 | C12 | C2B | 117.9° | 120.1° |
| C12 | C3 | H3 | 120.4° | 120.0° |
| C5 | N1 | C6 | 108.2° | 108.9° |
| N1 | C5 | C7 | 102.3° | 103.7° |
| N1 | C5 | H5 | 111.9° | 110.6° |
| N1 | C5 | H5A | 113.4° | 110.6° |
| N1 | C6 | O1 | 108.2° | 113.9° |
| N1 | C6 | O3 | 122.0° | 123.1° |
| C4 | C11 | C12 | 123.2° | 119.9° |
| C4 | C11 | F1 | 115.0° | 120.0° |
| C11 | C4 | H4 | 121.5° | 120.0° |
| C5 | C7 | C8 | 110.5° | 110.5° |
| C5 | C7 | O1 | 107.9° | 104.0° |
| C7 | C5 | H5 | 111.9° | 110.6° |
| C7 | C5 | H5A | 113.4° | 110.6° |
| C5 | C7 | H7 | 108.9° | 110.5° |
| O1 | C6 | O3 | 129.8° | 123.1° |
| C6 | O1 | C7 | 107.8° | 109.5° |
| C8 | C7 | O1 | 106.4° | 110.7° |
| C7 | C8 | N2 | 106.4° | 109.5° |
| C8 | C7 | H7 | 110.3° | 110.5° |
| C7 | C8 | H8 | 110.5° | 109.5° |
| C7 | C8 | H8A | 111.2° | 109.5° |
| O1 | C7 | H7 | 112.8° | 110.5° |
| C8 | N2 | C9 | 126.3° | 120.0° |
| N2 | C8 | H8 | 110.5° | 109.5° |
| N2 | C8 | H8A | 111.2° | 109.5° |
| C8 | N2 | HN2 | 116.8° | 120.0° |
| N2 | C9 | C10 | 117.0° | 120.0° |
| N2 | C9 | O2 | 123.3° | 120.0° |
| C9 | N2 | HN2 | 116.8° | 120.0° |
| C10 | C9 | O2 | 119.7° | 120.0° |
| C9 | C10 | H10 | 109.5° | 109.4° |
| C9 | C10 | H10A | 109.5° | 109.5° |
| C9 | C10 | H10B | 109.4° | 109.5° |
| C12 | C11 | F1 | 121.6° | 120.1° |
| C11 | C12 | C2B | 124.2° | 120.1° |
| C12 | C2B | C3B | 126.3° | 120.0° |
| C12 | C2B | H2B | 116.8° | 120.0° |
| C2B | C3B | C4B | 123.5° | 120.0° |
| C3B | C2B | H2B | 116.8° | 120.0° |
| C2B | C3B | H3B | 118.2° | 120.0° |
| C3B | C4B | C5B | 109.2° | 109.5° |
| C4B | C3B | H3B | 118.2° | 120.0° |
| C3B | C4B | H4B | 109.6° | 109.5° |
| C3B | C4B | H4BA | 109.6° | 109.5° |
| C4B | C5B | CAS | 122.4° | 109.5° |
| C5B | C4B | H4B | 109.6° | 109.5° |
| C5B | C4B | H4BA | 109.6° | 109.5° |
| C4B | C5B | H5B | 105.4° | 109.5° |
| C4B | C5B | H5BA | 102.4° | 109.4° |
| C5B | CAS | N5S | 121.4° | 109.4° |
| CAS | C5B | H5B | 105.4° | 109.5° |
| CAS | C5B | H5BA | 102.3° | 109.5° |
| C5B | CAS | HAS | 105.7° | 109.4° |
| C5B | CAS | HASA | 102.9° | 109.4° |
| CAS | N5S | C0S | 118.3° | 120.0° |
| N5S | CAS | HAS | 105.7° | 109.5° |
| N5S | CAS | HASA | 102.9° | 109.5° |
| CAS | N5S | HN5S | 120.9° | 120.1° |
| N5S | C0S | C9S | 109.9° | 120.0° |
| N5S | C0S | O2S | 123.4° | 120.0° |
| C0S | N5S | HN5S | 120.9° | 120.0° |
| C9S | C0S | O2S | 126.6° | 120.0° |
| C0S | C9S | C8S | 115.3° | 109.5° |
| C0S | C9S | H9S | 107.6° | 109.4° |
| C0S | C9S | H9SA | 106.2° | 109.5° |
| C9S | C8S | C6S | 129.5° | 120.0° |
| C8S | C9S | H9S | 107.6° | 109.5° |
| C8S | C9S | H9SA | 106.2° | 109.5° |
| C9S | C8S | H8S | 115.2° | 120.0° |
| C8S | C6S | C1S | 121.9° | 121.5° |
| C8S | C6S | C5S | 120.7° | 121.5° |
| C6S | C8S | H8S | 115.2° | 120.0° |
| O1S | C1S | N2S | 120.1° | 121.2° |
| O1S | C1S | C6S | 122.9° | 121.2° |
| N2S | C1S | C6S | 117.0° | 117.6° |
| C1S | N2S | C3S | 122.2° | 121.0° |
| C1S | N2S | HN2S | 118.9° | 119.5° |
| C1S | C6S | C5S | 117.3° | 117.0° |
| N2S | C3S | O3S | 119.1° | 118.2° |
| N2S | C3S | N4S | 121.5° | 123.6° |
| C3S | N2S | HN2S | 118.9° | 119.5° |
| O3S | C3S | N4S | 119.4° | 118.2° |
| C3S | N4S | C5S | 123.6° | 122.3° |
| N4S | C5S | C7S | 118.6° | 120.7° |
| N4S | C5S | C6S | 118.3° | 118.5° |
| C7S | C5S | C6S | 123.1° | 120.8° |
| C5S | C7S | H7S | 109.5° | 109.5° |
| C5S | C7S | H7SA | 109.4° | 109.4° |
| C5S | C7S | H7SB | 109.5° | 109.4° |
| H5 | C5 | H5A | 104.1° | 110.7° |
| H8 | C8 | H8A | 107.1° | 109.5° |
| H10 | C10 | H10A | 109.5° | 109.5° |
| H10 | C10 | H10B | 109.5° | 109.5° |
| H10A | C10 | H10B | 109.5° | 109.5° |
| H4B | C4B | H4BA | 109.3° | 109.4° |
| H5B | C5B | H5BA | 120.2° | 109.5° |
| HAS | CAS | HASA | 119.4° | 109.5° |
| H9S | C9S | H9SA | 114.2° | 109.4° |
| H7S | C7S | H7SA | 109.5° | 109.5° |
| H7S | C7S | H7SB | 109.5° | 109.5° |
| H7SA | C7S | H7SB | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C3 | H1 | 180.0° | 179.7° |
| C1 | C2 | N1 | C4 | 178.4° | 180.0° |
| C2 | C1 | C3 | C12 | 2.4° | 0.0° |
| C1 | C2 | N1 | C5 | 27.9° | 6.7° |
| C1 | C2 | N1 | C6 | 152.7° | 173.0° |
| C1 | C2 | C4 | C11 | 0.4° | 0.0° |
| C2 | C1 | C3 | H3 | 177.6° | 179.9° |
| C1 | C2 | C4 | H4 | 179.6° | 180.0° |
| C3 | C1 | C2 | N1 | 178.7° | 180.0° |
| C3 | C1 | C2 | C4 | 0.3° | 0.0° |
| C1 | C3 | C12 | H3 | 180.0° | 179.9° |
| C1 | C3 | C12 | C11 | 4.5° | 0.0° |
| C1 | C3 | C12 | C2B | 179.3° | 180.0° |
| C2 | N1 | C5 | C6 | 179.5° | 179.8° |
| N1 | C2 | C4 | C11 | 178.7° | 180.0° |
| C2 | N1 | C5 | C7 | 176.5° | 180.0° |
| C2 | N1 | C6 | O1 | 162.7° | 180.0° |
| C2 | N1 | C6 | O3 | 16.3° | 0.0° |
| N1 | C2 | C1 | H1 | 1.3° | 0.3° |
| N1 | C2 | C4 | H4 | 1.2° | 0.0° |
| C2 | N1 | C5 | H5 | 56.5° | 61.4° |
| C2 | N1 | C5 | H5A | 61.0° | 61.5° |
| C4 | C2 | N1 | C5 | 150.5° | 173.3° |
| C4 | C2 | N1 | C6 | 28.9° | 7.0° |
| C2 | C4 | C11 | H4 | 180.0° | 180.0° |
| C2 | C4 | C11 | C12 | 2.7° | 0.0° |
| C2 | C4 | C11 | F1 | 178.0° | 180.0° |
| C4 | C2 | C1 | H1 | 179.7° | 179.7° |
| C3 | C12 | C11 | C4 | 4.8° | 0.0° |
| C3 | C12 | C11 | C2B | 176.0° | 180.0° |
| C3 | C12 | C11 | F1 | 179.8° | 180.0° |
| C3 | C12 | C2B | C3B | 178.1° | 0.1° |
| C12 | C3 | C1 | H1 | 177.5° | 179.7° |
| C3 | C12 | C2B | H2B | 1.9° | 180.0° |
| N1 | C5 | C7 | H5 | 120.0° | 118.6° |
| N1 | C5 | C7 | H5A | 122.6° | 118.5° |
| C5 | N1 | C6 | O1 | 16.8° | 0.3° |
| C5 | N1 | C6 | O3 | 164.3° | 179.7° |
| N1 | C5 | C7 | C8 | 127.4° | 118.7° |
| N1 | C5 | C7 | O1 | 11.5° | 0.2° |
| N1 | C5 | H5 | H5A | 122.9° | 122.9° |
| N1 | C5 | C7 | H7 | 111.3° | 118.7° |
| C6 | N1 | C5 | C7 | 3.0° | 0.3° |
| N1 | C6 | O1 | O3 | 178.9° | 180.0° |
| N1 | C6 | O1 | C7 | 24.4° | 0.1° |
| C6 | N1 | C5 | H5 | 123.0° | 118.8° |
| C6 | N1 | C5 | H5A | 119.5° | 118.3° |
| C4 | C11 | C12 | F1 | 174.9° | 179.9° |
| C4 | C11 | C12 | C2B | 179.2° | 180.0° |
| C5 | C7 | O1 | C6 | 22.3° | 0.0° |
| C5 | C7 | C8 | O1 | 116.9° | 114.7° |
| C5 | C7 | C8 | H7 | 120.5° | 122.6° |
| C5 | C7 | O1 | H7 | 120.3° | 118.6° |
| C5 | C7 | C8 | N2 | 82.2° | 180.0° |
| C7 | C5 | H5 | H5A | 122.9° | 122.8° |
| C5 | C7 | C8 | H8 | 37.8° | 60.0° |
| C5 | C7 | C8 | H8A | 156.6° | 60.0° |
| C6 | O1 | C7 | C8 | 140.9° | 118.7° |
| C6 | O1 | C7 | H7 | 98.0° | 118.6° |
| O3 | C6 | O1 | C7 | 156.7° | 179.9° |
| C8 | C7 | O1 | H7 | 121.1° | 122.7° |
| C7 | C8 | N2 | H8 | 120.0° | 120.0° |
| C7 | C8 | N2 | H8A | 121.2° | 120.0° |
| C7 | C8 | N2 | C9 | 90.0° | 179.9° |
| C8 | C7 | C5 | H5 | 7.4° | 0.1° |
| C8 | C7 | C5 | H5A | 110.1° | 122.8° |
| C7 | C8 | H8 | H8A | 121.2° | 120.0° |
| C7 | C8 | N2 | HN2 | 90.0° | 0.0° |
| O1 | C7 | C8 | N2 | 34.6° | 65.4° |
| O1 | C7 | C5 | H5 | 108.5° | 118.7° |
| O1 | C7 | C5 | H5A | 134.0° | 118.4° |
| O1 | C7 | C8 | H8 | 154.6° | 54.7° |
| O1 | C7 | C8 | H8A | 86.6° | 174.6° |
| C8 | N2 | C9 | HN2 | 180.0° | 179.9° |
| C8 | N2 | C9 | C10 | 180.0° | 180.0° |
| C8 | N2 | C9 | O2 | 0.2° | 0.1° |
| N2 | C8 | C7 | H7 | 157.3° | 57.4° |
| N2 | C8 | H8 | H8A | 121.3° | 120.0° |
| N2 | C9 | C10 | O2 | 179.8° | 179.9° |
| C9 | N2 | C8 | H8 | 30.0° | 59.9° |
| C9 | N2 | C8 | H8A | 148.8° | 60.1° |
| N2 | C9 | C10 | H10 | 80.6° | 90.1° |
| N2 | C9 | C10 | H10A | 159.3° | 150.0° |
| N2 | C9 | C10 | H10B | 39.4° | 29.9° |
| C10 | C9 | N2 | HN2 | 0.0° | 0.1° |
| C9 | C10 | H10 | H10A | 120.0° | 120.0° |
| C9 | C10 | H10 | H10B | 120.0° | 120.0° |
| C9 | C10 | H10A | H10B | 119.9° | 120.0° |
| O2 | C9 | N2 | HN2 | 179.8° | 179.9° |
| O2 | C9 | C10 | H10 | 99.1° | 90.1° |
| O2 | C9 | C10 | H10A | 20.9° | 29.9° |
| O2 | C9 | C10 | H10B | 140.9° | 149.9° |
| C11 | C12 | C2B | C3B | 5.9° | 179.9° |
| C11 | C12 | C3 | H3 | 175.5° | 179.9° |
| C12 | C11 | C4 | H4 | 177.2° | 180.0° |
| C11 | C12 | C2B | H2B | 174.1° | 0.0° |
| F1 | C11 | C12 | C2B | 4.3° | 0.0° |
| F1 | C11 | C4 | H4 | 2.0° | 0.0° |
| C12 | C2B | C3B | H2B | 180.0° | 179.9° |
| C12 | C2B | C3B | C4B | 176.4° | 180.0° |
| C2B | C12 | C3 | H3 | 0.7° | 0.1° |
| C12 | C2B | C3B | H3B | 3.6° | 0.1° |
| C2B | C3B | C4B | H3B | 180.0° | 179.9° |
| C2B | C3B | C4B | C5B | 81.7° | 125.0° |
| C2B | C3B | C4B | H4B | 38.3° | 114.9° |
| C2B | C3B | C4B | H4BA | 158.2° | 5.0° |
| C3B | C4B | C5B | H4B | 120.0° | 120.1° |
| C3B | C4B | C5B | H4BA | 120.1° | 120.0° |
| C3B | C4B | C5B | CAS | 178.7° | 180.0° |
| C4B | C3B | C2B | H2B | 3.5° | 0.0° |
| C3B | C4B | H4B | H4BA | 120.1° | 120.0° |
| C3B | C4B | C5B | H5B | 61.3° | 59.9° |
| C3B | C4B | C5B | H5BA | 65.3° | 60.0° |
| C4B | C5B | CAS | H5B | 120.0° | 120.0° |
| C4B | C5B | CAS | H5BA | 113.5° | 120.0° |
| C4B | C5B | CAS | N5S | 8.7° | 180.0° |
| C5B | C4B | C3B | H3B | 98.3° | 55.1° |
| C5B | C4B | H4B | H4BA | 120.1° | 120.0° |
| C4B | C5B | H5B | H5BA | 114.7° | 119.9° |
| C4B | C5B | CAS | HAS | 111.3° | 60.0° |
| C4B | C5B | CAS | HASA | 122.8° | 60.0° |
| C5B | CAS | N5S | HAS | 120.0° | 119.9° |
| C5B | CAS | N5S | HASA | 114.1° | 120.0° |
| C5B | CAS | N5S | C0S | 112.6° | 180.0° |
| CAS | C5B | C4B | H4B | 58.7° | 59.9° |
| CAS | C5B | C4B | H4BA | 61.2° | 60.0° |
| CAS | C5B | H5B | H5BA | 114.7° | 120.0° |
| C5B | CAS | HAS | HASA | 115.1° | 120.0° |
| C5B | CAS | N5S | HN5S | 67.5° | 0.1° |
| CAS | N5S | C0S | HN5S | 180.0° | 179.9° |
| CAS | N5S | C0S | C9S | 177.1° | 180.0° |
| CAS | N5S | C0S | O2S | 1.7° | 0.0° |
| N5S | CAS | C5B | H5B | 128.7° | 60.0° |
| N5S | CAS | C5B | H5BA | 104.8° | 60.0° |
| N5S | CAS | HAS | HASA | 115.1° | 120.1° |
| N5S | C0S | C9S | O2S | 178.8° | 180.0° |
| N5S | C0S | C9S | C8S | 179.5° | 180.0° |
| C0S | N5S | CAS | HAS | 127.5° | 60.1° |
| C0S | N5S | CAS | HASA | 1.5° | 60.0° |
| N5S | C0S | C9S | H9S | 59.5° | 60.0° |
| N5S | C0S | C9S | H9SA | 63.1° | 60.0° |
| C0S | C9S | C8S | H9S | 120.0° | 120.0° |
| C0S | C9S | C8S | H9SA | 117.3° | 120.0° |
| C0S | C9S | C8S | C6S | 179.7° | 128.6° |
| C9S | C0S | N5S | HN5S | 2.9° | 0.0° |
| C0S | C9S | H9S | H9SA | 117.6° | 119.9° |
| C0S | C9S | C8S | H8S | 0.3° | 51.5° |
| O2S | C0S | C9S | C8S | 1.7° | 0.0° |
| O2S | C0S | N5S | HN5S | 178.3° | 179.9° |
| O2S | C0S | C9S | H9S | 121.7° | 120.0° |
| O2S | C0S | C9S | H9SA | 115.7° | 120.1° |
| C9S | C8S | C6S | H8S | 180.0° | 180.0° |
| C9S | C8S | C6S | C1S | 0.4° | 14.8° |
| C9S | C8S | C6S | C5S | 177.2° | 164.8° |
| C8S | C9S | H9S | H9SA | 117.6° | 120.0° |
| C8S | C6S | C1S | O1S | 1.9° | 0.1° |
| C8S | C6S | C1S | N2S | 178.5° | 179.8° |
| C8S | C6S | C1S | C5S | 177.7° | 179.7° |
| C8S | C6S | C5S | N4S | 178.3° | 179.7° |
| C8S | C6S | C5S | C7S | 2.0° | 0.1° |
| C6S | C8S | C9S | H9S | 60.3° | 8.6° |
| C6S | C8S | C9S | H9SA | 62.4° | 111.4° |
| O1S | C1S | N2S | C6S | 179.6° | 179.7° |
| O1S | C1S | N2S | C3S | 179.2° | 180.0° |
| O1S | C1S | C6S | C5S | 179.5° | 179.7° |
| O1S | C1S | N2S | HN2S | 0.8° | 0.0° |
| C1S | N2S | C3S | HN2S | 180.0° | 180.0° |
| C1S | N2S | C3S | O3S | 178.0° | 180.0° |
| C1S | N2S | C3S | N4S | 1.3° | 0.1° |
| N2S | C1S | C6S | C5S | 0.8° | 0.5° |
| C6S | C1S | N2S | C3S | 1.2° | 0.2° |
| C1S | C6S | C5S | N4S | 0.6° | 0.6° |
| C1S | C6S | C5S | C7S | 179.8° | 179.7° |
| C1S | C6S | C8S | H8S | 179.6° | 165.1° |
| C6S | C1S | N2S | HN2S | 178.8° | 179.7° |
| N2S | C3S | O3S | N4S | 179.3° | 180.0° |
| N2S | C3S | N4S | C5S | 1.0° | 0.0° |
| O3S | C3S | N4S | C5S | 178.3° | 180.0° |
| O3S | C3S | N2S | HN2S | 2.0° | 0.0° |
| C3S | N4S | C5S | C7S | 179.7° | 180.0° |
| C3S | N4S | C5S | C6S | 0.7° | 0.3° |
| N4S | C3S | N2S | HN2S | 178.7° | 180.0° |
| N4S | C5S | C7S | C6S | 179.7° | 179.7° |
| N4S | C5S | C7S | H7S | 61.0° | 0.0° |
| N4S | C5S | C7S | H7SA | 59.0° | 120.0° |
| N4S | C5S | C7S | H7SB | 179.0° | 120.0° |
| C5S | C7S | H7S | H7SA | 120.0° | 120.0° |
| C5S | C7S | H7S | H7SB | 120.0° | 119.9° |
| C5S | C7S | H7SA | H7SB | 120.0° | 119.9° |
| C5S | C6S | C8S | H8S | 2.8° | 15.2° |
| C6S | C5S | C7S | H7S | 119.3° | 179.7° |
| C6S | C5S | C7S | H7SA | 120.7° | 59.7° |
| C6S | C5S | C7S | H7SB | 0.7° | 60.3° |
| H1 | C1 | C3 | H3 | 2.5° | 0.3° |
| H5 | C5 | C7 | H7 | 128.7° | 122.7° |
| H5A | C5 | C7 | H7 | 11.3° | 0.2° |
| H7 | C7 | C8 | H8 | 82.7° | 177.4° |
| H7 | C7 | C8 | H8A | 36.1° | 62.6° |
| H8 | C8 | N2 | HN2 | 150.0° | 120.0° |
| H8A | C8 | N2 | HN2 | 31.1° | 120.0° |
| H10 | C10 | H10A | H10B | 120.0° | 120.0° |
| H2B | C2B | C3B | H3B | 176.5° | 180.0° |
| H3B | C3B | C4B | H4B | 141.7° | 65.0° |
| H3B | C3B | C4B | H4BA | 21.8° | 175.1° |
| H4B | C4B | C5B | H5B | 178.7° | 180.0° |
| H4B | C4B | C5B | H5BA | 54.7° | 60.0° |
| H4BA | C4B | C5B | H5B | 58.8° | 60.1° |
| H4BA | C4B | C5B | H5BA | 174.7° | 180.0° |
| H5B | C5B | CAS | HAS | 8.7° | 180.0° |
| H5B | C5B | CAS | HASA | 117.2° | 60.0° |
| H5BA | C5B | CAS | HAS | 135.2° | 60.0° |
| H5BA | C5B | CAS | HASA | 9.3° | 180.0° |
| HAS | CAS | N5S | HN5S | 52.5° | 120.0° |
| HASA | CAS | N5S | HN5S | 178.5° | 119.9° |
| H9S | C9S | C8S | H8S | 119.8° | 171.4° |
| H9SA | C9S | C8S | H8S | 117.6° | 68.6° |
| H7S | C7S | H7SA | H7SB | 120.0° | 120.1° |
