CN8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O5 | C29 | doub | 1.21Å | 1.24Å | |
| C29 | N8 | sing | 1.35Å | 1.34Å | |
| C29 | C27 | sing | 1.51Å | 1.53Å | |
| N8 | C30 | sing | 1.47Å | 1.46Å | |
| C30 | C31 | sing | 1.53Å | 1.53Å | |
| C27 | N7 | sing | 1.47Å | 1.48Å | |
| C27 | C28 | sing | 1.54Å | 1.53Å | |
| N7 | C26 | sing | 1.48Å | 1.49Å | |
| C26 | C25 | sing | 1.55Å | 1.53Å | |
| C28 | C25 | sing | 1.55Å | 1.53Å | |
| C25 | N6 | sing | 1.47Å | 1.46Å | |
| N6 | C16 | sing | 1.35Å | 1.36Å | |
| C16 | O4 | doub | 1.21Å | 1.23Å | |
| C16 | C15 | sing | 1.51Å | 1.52Å | |
| C15 | N5 | sing | 1.47Å | 1.49Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| N5 | C17 | sing | 1.47Å | 1.39Å | |
| C14 | C12 | sing | 1.51Å | 1.52Å | |
| C12 | N4 | sing | 1.34Å | 1.36Å | Aromatic |
| C12 | C13 | doub | 1.35Å | 1.40Å | Aromatic |
| N4 | N3 | doub | 1.29Å | 1.40Å | Aromatic |
| N3 | N2 | sing | 1.29Å | 1.40Å | Aromatic |
| C13 | N2 | sing | 1.35Å | 1.34Å | Aromatic |
| N2 | C11 | sing | 1.46Å | 1.47Å | |
| C11 | C10 | sing | 1.53Å | 1.52Å | |
| C10 | N1 | sing | 1.46Å | 1.45Å | |
| N1 | C9 | sing | 1.35Å | 1.32Å | |
| C9 | O1 | doub | 1.22Å | 1.22Å | |
| C9 | C4 | sing | 1.47Å | 1.50Å | |
| C4 | C3 | sing | 1.40Å | 1.38Å | Aromatic |
| C4 | C5 | doub | 1.40Å | 1.41Å | Aromatic |
| C3 | C2 | doub | 1.37Å | 1.37Å | Aromatic |
| C2 | C1 | sing | 1.39Å | 1.40Å | Aromatic |
| C1 | S1 | sing | 1.76Å | 1.69Å | |
| C1 | C6 | doub | 1.39Å | 1.40Å | Aromatic |
| C6 | C5 | sing | 1.37Å | 1.38Å | Aromatic |
| N8 | H8 | sing | 0.97Å | 1.00Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C30 | H302 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C31 | H313 | sing | 1.09Å | 1.10Å | |
| N7 | H7 | sing | 1.01Å | 1.00Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| N6 | H6 | sing | 0.97Å | 1.00Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| N5 | H5 | sing | 1.01Å | 1.00Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H173 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | HA | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| S1 | HB | sing | 1.35Å | 1.30Å | |
| C6 | HC | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O5 | C29 | N8 | 122.3° | 120.0° |
| O5 | C29 | C27 | 122.8° | 120.0° |
| N8 | C29 | C27 | 114.9° | 120.0° |
| C29 | N8 | C30 | 123.8° | 120.0° |
| C29 | N8 | H8 | 118.1° | 120.0° |
| C29 | C27 | N7 | 111.3° | 109.9° |
| C29 | C27 | C28 | 112.4° | 109.9° |
| C29 | C27 | H27 | 108.7° | 109.9° |
| N8 | C30 | C31 | 109.9° | 109.4° |
| C30 | N8 | H8 | 118.1° | 120.0° |
| N8 | C30 | H301 | 109.4° | 109.5° |
| N8 | C30 | H302 | 109.4° | 109.5° |
| C31 | C30 | H301 | 109.3° | 109.5° |
| C31 | C30 | H302 | 109.4° | 109.5° |
| C30 | C31 | H311 | 109.5° | 109.5° |
| C30 | C31 | H312 | 109.4° | 109.5° |
| C30 | C31 | H313 | 109.4° | 109.5° |
| N7 | C27 | C28 | 106.3° | 107.3° |
| C27 | N7 | C26 | 106.9° | 108.6° |
| N7 | C27 | H27 | 109.4° | 109.9° |
| C27 | N7 | H7 | 110.1° | 111.0° |
| C27 | C28 | C25 | 104.4° | 103.0° |
| C28 | C27 | H27 | 108.7° | 110.0° |
| C27 | C28 | H281 | 110.7° | 110.8° |
| C27 | C28 | H282 | 110.7° | 110.7° |
| N7 | C26 | C25 | 108.4° | 104.8° |
| C26 | N7 | H7 | 110.1° | 111.0° |
| N7 | C26 | H261 | 109.7° | 110.4° |
| N7 | C26 | H262 | 109.7° | 110.4° |
| C26 | C25 | C28 | 105.1° | 101.6° |
| C26 | C25 | N6 | 109.9° | 111.0° |
| C25 | C26 | H261 | 109.7° | 110.3° |
| C25 | C26 | H262 | 109.7° | 110.4° |
| C26 | C25 | H25 | 109.9° | 111.0° |
| C28 | C25 | N6 | 110.9° | 111.0° |
| C25 | C28 | H281 | 110.7° | 110.7° |
| C25 | C28 | H282 | 110.7° | 110.7° |
| C28 | C25 | H25 | 110.0° | 111.0° |
| C25 | N6 | C16 | 124.8° | 120.0° |
| N6 | C25 | H25 | 110.9° | 110.9° |
| C25 | N6 | H6 | 117.6° | 120.0° |
| N6 | C16 | O4 | 122.6° | 120.0° |
| N6 | C16 | C15 | 120.5° | 120.0° |
| C16 | N6 | H6 | 117.6° | 120.0° |
| O4 | C16 | C15 | 116.8° | 120.0° |
| C16 | C15 | N5 | 116.0° | 109.5° |
| C16 | C15 | C14 | 110.5° | 109.5° |
| C16 | C15 | H15 | 106.0° | 109.5° |
| N5 | C15 | C14 | 111.4° | 109.4° |
| C15 | N5 | C17 | 107.6° | 111.0° |
| N5 | C15 | H15 | 106.4° | 109.5° |
| C15 | N5 | H5 | 109.9° | 111.0° |
| C15 | C14 | C12 | 118.1° | 109.5° |
| C14 | C15 | H15 | 105.8° | 109.5° |
| C15 | C14 | H141 | 107.3° | 109.5° |
| C15 | C14 | H142 | 107.3° | 109.4° |
| C17 | N5 | H5 | 110.0° | 110.9° |
| N5 | C17 | H171 | 109.5° | 109.5° |
| N5 | C17 | H172 | 109.5° | 109.5° |
| N5 | C17 | H173 | 109.5° | 109.5° |
| C14 | C12 | N4 | 127.0° | 126.8° |
| C14 | C12 | C13 | 124.7° | 126.8° |
| C12 | C14 | H141 | 107.3° | 109.5° |
| C12 | C14 | H142 | 107.3° | 109.5° |
| N4 | C12 | C13 | 108.2° | 106.5° |
| C12 | N4 | N3 | 109.4° | 108.9° |
| C12 | C13 | N2 | 107.2° | 106.2° |
| C12 | C13 | H13 | 126.4° | 126.9° |
| N4 | N3 | N2 | 104.1° | 110.2° |
| N3 | N2 | C13 | 111.1° | 108.2° |
| N3 | N2 | C11 | 116.8° | 125.9° |
| C13 | N2 | C11 | 132.1° | 125.9° |
| N2 | C13 | H13 | 126.4° | 126.9° |
| N2 | C11 | C10 | 106.1° | 109.5° |
| N2 | C11 | H111 | 110.3° | 109.5° |
| N2 | C11 | H112 | 110.3° | 109.5° |
| C11 | C10 | N1 | 109.5° | 109.5° |
| C10 | C11 | H111 | 110.3° | 109.5° |
| C10 | C11 | H112 | 110.3° | 109.5° |
| C11 | C10 | H101 | 109.5° | 109.4° |
| C11 | C10 | H102 | 109.5° | 109.4° |
| C10 | N1 | C9 | 118.8° | 120.0° |
| N1 | C10 | H101 | 109.5° | 109.5° |
| N1 | C10 | H102 | 109.5° | 109.5° |
| C10 | N1 | H1 | 120.6° | 120.0° |
| N1 | C9 | O1 | 121.3° | 120.0° |
| N1 | C9 | C4 | 119.5° | 120.0° |
| C9 | N1 | H1 | 120.6° | 120.0° |
| O1 | C9 | C4 | 119.1° | 119.9° |
| C9 | C4 | C3 | 119.1° | 120.1° |
| C9 | C4 | C5 | 119.8° | 120.1° |
| C3 | C4 | C5 | 121.1° | 119.8° |
| C4 | C3 | C2 | 119.4° | 120.0° |
| C4 | C3 | H3 | 120.3° | 120.0° |
| C4 | C5 | C6 | 119.7° | 119.9° |
| C4 | C5 | HA | 120.2° | 120.0° |
| C3 | C2 | C1 | 119.8° | 120.1° |
| C2 | C3 | H3 | 120.3° | 120.0° |
| C3 | C2 | H2 | 120.1° | 120.0° |
| C2 | C1 | S1 | 122.8° | 119.9° |
| C2 | C1 | C6 | 121.3° | 120.1° |
| C1 | C2 | H2 | 120.1° | 119.9° |
| S1 | C1 | C6 | 115.8° | 120.0° |
| C1 | S1 | HB | 102.0° | 103.0° |
| C1 | C6 | C5 | 118.6° | 120.1° |
| C1 | C6 | HC | 120.7° | 119.9° |
| C6 | C5 | HA | 120.2° | 120.1° |
| C5 | C6 | HC | 120.7° | 120.0° |
| H301 | C30 | H302 | 109.5° | 109.5° |
| H311 | C31 | H312 | 109.5° | 109.5° |
| H311 | C31 | H313 | 109.4° | 109.5° |
| H312 | C31 | H313 | 109.5° | 109.4° |
| H281 | C28 | H282 | 109.5° | 110.7° |
| H261 | C26 | H262 | 109.5° | 110.5° |
| H141 | C14 | H142 | 109.5° | 109.4° |
| H171 | C17 | H172 | 109.5° | 109.5° |
| H171 | C17 | H173 | 109.4° | 109.4° |
| H172 | C17 | H173 | 109.4° | 109.5° |
| H111 | C11 | H112 | 109.5° | 109.5° |
| H101 | C10 | H102 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O5 | C29 | N8 | C27 | 179.6° | 179.7° |
| O5 | C29 | N8 | C30 | 4.4° | 0.0° |
| O5 | C29 | C27 | N7 | 82.8° | 18.6° |
| O5 | C29 | C27 | C28 | 36.4° | 99.2° |
| O5 | C29 | N8 | H8 | 175.6° | 180.0° |
| O5 | C29 | C27 | H27 | 156.8° | 139.6° |
| C29 | N8 | C30 | H8 | 180.0° | 180.0° |
| C29 | N8 | C30 | C31 | 176.9° | 180.0° |
| N8 | C29 | C27 | N7 | 97.6° | 161.2° |
| N8 | C29 | C27 | C28 | 143.2° | 81.1° |
| N8 | C29 | C27 | H27 | 22.8° | 40.1° |
| C29 | N8 | C30 | H301 | 56.9° | 60.0° |
| C29 | N8 | C30 | H302 | 63.0° | 60.0° |
| C27 | C29 | N8 | C30 | 175.2° | 179.7° |
| C29 | C27 | N7 | C28 | 122.7° | 119.4° |
| C29 | C27 | N7 | H27 | 120.1° | 121.0° |
| C29 | C27 | C28 | H27 | 120.4° | 121.1° |
| C29 | C27 | N7 | C26 | 98.1° | 118.4° |
| C29 | C27 | C28 | C25 | 91.5° | 141.7° |
| C27 | C29 | N8 | H8 | 4.8° | 0.3° |
| C29 | C27 | N7 | H7 | 142.3° | 119.3° |
| C29 | C27 | C28 | H281 | 27.7° | 23.3° |
| C29 | C27 | C28 | H282 | 149.3° | 100.0° |
| N8 | C30 | C31 | H301 | 120.1° | 119.9° |
| N8 | C30 | C31 | H302 | 120.0° | 120.0° |
| N8 | C30 | H301 | H302 | 119.8° | 120.0° |
| N8 | C30 | C31 | H311 | 180.0° | 60.0° |
| N8 | C30 | C31 | H312 | 60.0° | 60.0° |
| N8 | C30 | C31 | H313 | 60.0° | 179.9° |
| C31 | C30 | N8 | H8 | 3.1° | 0.0° |
| C31 | C30 | H301 | H302 | 119.8° | 120.0° |
| C30 | C31 | H311 | H312 | 120.0° | 120.1° |
| C30 | C31 | H311 | H313 | 120.0° | 120.0° |
| C30 | C31 | H312 | H313 | 120.0° | 120.0° |
| N7 | C27 | C28 | H27 | 117.6° | 119.5° |
| C27 | N7 | C26 | H7 | 119.6° | 122.3° |
| C27 | N7 | C26 | C25 | 9.1° | 24.1° |
| N7 | C27 | C28 | C25 | 30.5° | 22.3° |
| N7 | C27 | C28 | H281 | 149.7° | 96.1° |
| N7 | C27 | C28 | H282 | 88.7° | 140.7° |
| C27 | N7 | C26 | H261 | 129.0° | 142.8° |
| C27 | N7 | C26 | H262 | 110.7° | 94.7° |
| C28 | C27 | N7 | C26 | 24.6° | 1.0° |
| C27 | C28 | C25 | C26 | 24.2° | 35.7° |
| C27 | C28 | C25 | H281 | 119.2° | 118.5° |
| C27 | C28 | C25 | H282 | 119.2° | 118.4° |
| C27 | C28 | C25 | N6 | 94.5° | 153.8° |
| C28 | C27 | N7 | H7 | 95.0° | 121.3° |
| C27 | C28 | H281 | H282 | 122.3° | 123.2° |
| C27 | C28 | C25 | H25 | 142.5° | 82.4° |
| N7 | C26 | C25 | H261 | 119.8° | 118.8° |
| N7 | C26 | C25 | H262 | 119.8° | 118.8° |
| N7 | C26 | C25 | C28 | 9.8° | 37.1° |
| N7 | C26 | C25 | N6 | 109.6° | 155.1° |
| C26 | N7 | C27 | H27 | 141.8° | 120.6° |
| N7 | C26 | H261 | H262 | 120.5° | 122.4° |
| N7 | C26 | C25 | H25 | 128.1° | 81.1° |
| C26 | C25 | C28 | N6 | 118.7° | 118.1° |
| C26 | C25 | C28 | H25 | 118.2° | 118.1° |
| C26 | C25 | N6 | H25 | 121.7° | 123.9° |
| C26 | C25 | N6 | C16 | 69.7° | 86.5° |
| C25 | C26 | N7 | H7 | 110.5° | 98.2° |
| C26 | C25 | C28 | H281 | 143.4° | 82.7° |
| C26 | C25 | C28 | H282 | 95.0° | 154.1° |
| C25 | C26 | H261 | H262 | 120.5° | 122.3° |
| C26 | C25 | N6 | H6 | 110.3° | 93.5° |
| C28 | C25 | N6 | H25 | 122.5° | 123.9° |
| C28 | C25 | N6 | C16 | 174.5° | 161.3° |
| C25 | C28 | C27 | H27 | 148.1° | 97.2° |
| C25 | C28 | H281 | H282 | 122.3° | 123.2° |
| C28 | C25 | C26 | H261 | 110.0° | 155.9° |
| C28 | C25 | C26 | H262 | 129.7° | 81.7° |
| C28 | C25 | N6 | H6 | 5.5° | 18.8° |
| C25 | N6 | C16 | H6 | 180.0° | 179.9° |
| C25 | N6 | C16 | O4 | 6.9° | 0.0° |
| C25 | N6 | C16 | C15 | 169.2° | 180.0° |
| N6 | C25 | C28 | H281 | 24.7° | 35.3° |
| N6 | C25 | C28 | H282 | 146.3° | 87.8° |
| N6 | C25 | C26 | H261 | 130.6° | 86.1° |
| N6 | C25 | C26 | H262 | 10.2° | 36.3° |
| N6 | C16 | O4 | C15 | 176.3° | 180.0° |
| N6 | C16 | C15 | N5 | 15.5° | 153.7° |
| N6 | C16 | C15 | C14 | 112.5° | 86.4° |
| C16 | N6 | C25 | H25 | 52.0° | 37.4° |
| N6 | C16 | C15 | H15 | 133.3° | 33.6° |
| O4 | C16 | C15 | N5 | 160.8° | 26.4° |
| O4 | C16 | C15 | C14 | 71.2° | 93.6° |
| O4 | C16 | N6 | H6 | 173.0° | 179.9° |
| O4 | C16 | C15 | H15 | 43.0° | 146.4° |
| C16 | C15 | N5 | C14 | 127.6° | 120.0° |
| C16 | C15 | N5 | H15 | 117.6° | 120.0° |
| C16 | C15 | C14 | H15 | 114.3° | 120.0° |
| C16 | C15 | N5 | C17 | 84.4° | 84.0° |
| C16 | C15 | C14 | C12 | 71.0° | 175.0° |
| C15 | C16 | N6 | H6 | 10.8° | 0.0° |
| C16 | C15 | N5 | H5 | 35.4° | 39.9° |
| C16 | C15 | C14 | H141 | 50.3° | 65.0° |
| C16 | C15 | C14 | H142 | 167.8° | 55.0° |
| N5 | C15 | C14 | H15 | 115.2° | 120.0° |
| C15 | N5 | C17 | H5 | 119.7° | 123.9° |
| N5 | C15 | C14 | C12 | 59.5° | 65.0° |
| N5 | C15 | C14 | H141 | 179.3° | 55.0° |
| N5 | C15 | C14 | H142 | 61.7° | 175.0° |
| C15 | N5 | C17 | H171 | 180.0° | 55.2° |
| C15 | N5 | C17 | H172 | 60.0° | 64.8° |
| C15 | N5 | C17 | H173 | 60.0° | 175.2° |
| C14 | C15 | N5 | C17 | 148.1° | 156.0° |
| C15 | C14 | C12 | H141 | 121.2° | 120.1° |
| C15 | C14 | C12 | H142 | 121.2° | 120.0° |
| C15 | C14 | C12 | N4 | 74.7° | 54.9° |
| C15 | C14 | C12 | C13 | 109.8° | 124.7° |
| C14 | C15 | N5 | H5 | 92.2° | 80.1° |
| C15 | C14 | H141 | H142 | 116.1° | 119.9° |
| C17 | N5 | C15 | H15 | 33.2° | 36.0° |
| N5 | C17 | H171 | H172 | 120.0° | 120.1° |
| N5 | C17 | H171 | H173 | 120.0° | 120.0° |
| N5 | C17 | H172 | H173 | 120.0° | 120.0° |
| C14 | C12 | N4 | C13 | 176.0° | 179.7° |
| C14 | C12 | N4 | N3 | 177.8° | 179.9° |
| C14 | C12 | C13 | N2 | 177.2° | 179.9° |
| C12 | C14 | C15 | H15 | 174.7° | 55.0° |
| C12 | C14 | H141 | H142 | 116.1° | 120.0° |
| C14 | C12 | C13 | H13 | 2.8° | 0.1° |
| C12 | N4 | N3 | N2 | 1.8° | 0.0° |
| N4 | C12 | C13 | N2 | 1.0° | 0.4° |
| N4 | C12 | C14 | H141 | 46.5° | 175.0° |
| N4 | C12 | C14 | H142 | 164.1° | 65.1° |
| N4 | C12 | C13 | H13 | 178.9° | 179.8° |
| C13 | C12 | N4 | N3 | 1.8° | 0.3° |
| C12 | C13 | N2 | N3 | 0.1° | 0.4° |
| C12 | C13 | N2 | H13 | 180.0° | 179.9° |
| C12 | C13 | N2 | C11 | 177.8° | 179.9° |
| C13 | C12 | C14 | H141 | 128.9° | 4.6° |
| C13 | C12 | C14 | H142 | 11.4° | 115.3° |
| N4 | N3 | N2 | C13 | 1.2° | 0.3° |
| N4 | N3 | N2 | C11 | 179.3° | 180.0° |
| N3 | N2 | C13 | C11 | 177.7° | 179.7° |
| N3 | N2 | C11 | C10 | 97.0° | 55.0° |
| N3 | N2 | C13 | H13 | 179.9° | 179.7° |
| N3 | N2 | C11 | H111 | 22.5° | 65.0° |
| N3 | N2 | C11 | H112 | 143.6° | 175.0° |
| C13 | N2 | C11 | C10 | 80.6° | 125.3° |
| C13 | N2 | C11 | H111 | 159.9° | 114.7° |
| C13 | N2 | C11 | H112 | 38.8° | 5.3° |
| N2 | C11 | C10 | H111 | 119.5° | 120.0° |
| N2 | C11 | C10 | H112 | 119.4° | 120.0° |
| N2 | C11 | C10 | N1 | 68.6° | 180.0° |
| C11 | N2 | C13 | H13 | 2.2° | 0.0° |
| N2 | C11 | H111 | H112 | 121.6° | 120.0° |
| N2 | C11 | C10 | H101 | 171.4° | 60.0° |
| N2 | C11 | C10 | H102 | 51.4° | 59.9° |
| C11 | C10 | N1 | H101 | 120.0° | 120.0° |
| C11 | C10 | N1 | H102 | 120.0° | 120.0° |
| C11 | C10 | N1 | C9 | 74.7° | 180.0° |
| C10 | C11 | H111 | H112 | 121.5° | 120.0° |
| C11 | C10 | H101 | H102 | 120.0° | 119.9° |
| C11 | C10 | N1 | H1 | 105.3° | 0.0° |
| C10 | N1 | C9 | H1 | 180.0° | 180.0° |
| C10 | N1 | C9 | O1 | 2.4° | 0.0° |
| C10 | N1 | C9 | C4 | 177.7° | 180.0° |
| N1 | C10 | C11 | H111 | 50.9° | 60.0° |
| N1 | C10 | C11 | H112 | 172.0° | 60.0° |
| N1 | C10 | H101 | H102 | 120.0° | 120.1° |
| N1 | C9 | O1 | C4 | 180.0° | 180.0° |
| N1 | C9 | C4 | C3 | 179.1° | 180.0° |
| N1 | C9 | C4 | C5 | 1.0° | 0.3° |
| C9 | N1 | C10 | H101 | 45.4° | 60.0° |
| C9 | N1 | C10 | H102 | 165.3° | 60.0° |
| O1 | C9 | C4 | C3 | 0.9° | 0.0° |
| O1 | C9 | C4 | C5 | 179.1° | 179.8° |
| O1 | C9 | N1 | H1 | 177.6° | 180.0° |
| C9 | C4 | C3 | C5 | 179.9° | 179.8° |
| C9 | C4 | C3 | C2 | 179.7° | 180.0° |
| C9 | C4 | C5 | C6 | 179.5° | 179.8° |
| C4 | C9 | N1 | H1 | 2.3° | 0.0° |
| C9 | C4 | C3 | H3 | 0.3° | 0.0° |
| C9 | C4 | C5 | HA | 0.5° | 0.0° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 0.4° | 0.0° |
| C3 | C4 | C5 | C6 | 0.6° | 0.5° |
| C3 | C4 | C5 | HA | 179.4° | 179.7° |
| C4 | C3 | C2 | H2 | 179.7° | 180.0° |
| C5 | C4 | C3 | C2 | 0.2° | 0.2° |
| C4 | C5 | C6 | C1 | 1.3° | 0.5° |
| C4 | C5 | C6 | HA | 180.0° | 179.8° |
| C5 | C4 | C3 | H3 | 179.8° | 179.8° |
| C4 | C5 | C6 | HC | 178.7° | 179.7° |
| C3 | C2 | C1 | H2 | 180.0° | 179.9° |
| C3 | C2 | C1 | S1 | 178.7° | 180.0° |
| C3 | C2 | C1 | C6 | 0.4° | 0.1° |
| C2 | C1 | S1 | C6 | 178.5° | 179.9° |
| C2 | C1 | C6 | C5 | 1.2° | 0.3° |
| C1 | C2 | C3 | H3 | 179.6° | 180.0° |
| C2 | C1 | S1 | HB | 180.0° | 90.1° |
| C2 | C1 | C6 | HC | 178.8° | 180.0° |
| S1 | C1 | C6 | C5 | 179.7° | 179.8° |
| S1 | C1 | C2 | H2 | 1.2° | 0.1° |
| S1 | C1 | C6 | HC | 0.3° | 0.0° |
| C1 | C6 | C5 | HC | 180.0° | 179.7° |
| C1 | C6 | C5 | HA | 178.7° | 179.7° |
| C6 | C1 | C2 | H2 | 179.6° | 180.0° |
| C6 | C1 | S1 | HB | 1.6° | 90.0° |
| H8 | N8 | C30 | H301 | 123.1° | 119.9° |
| H8 | N8 | C30 | H302 | 117.0° | 120.0° |
| H27 | C27 | N7 | H7 | 22.2° | 1.7° |
| H27 | C27 | C28 | H281 | 92.7° | 144.4° |
| H27 | C27 | C28 | H282 | 28.9° | 21.1° |
| H301 | C30 | C31 | H311 | 59.9° | 180.0° |
| H301 | C30 | C31 | H312 | 179.9° | 59.9° |
| H301 | C30 | C31 | H313 | 60.1° | 60.0° |
| H302 | C30 | C31 | H311 | 60.0° | 60.0° |
| H302 | C30 | C31 | H312 | 60.0° | 180.0° |
| H302 | C30 | C31 | H313 | 179.9° | 60.1° |
| H311 | C31 | H312 | H313 | 120.0° | 120.0° |
| H7 | N7 | C26 | H261 | 9.3° | 20.6° |
| H7 | N7 | C26 | H262 | 129.7° | 143.0° |
| H281 | C28 | C25 | H25 | 98.4° | 159.1° |
| H282 | C28 | C25 | H25 | 23.3° | 35.9° |
| H261 | C26 | C25 | H25 | 8.3° | 37.7° |
| H262 | C26 | C25 | H25 | 112.1° | 160.1° |
| H25 | C25 | N6 | H6 | 128.0° | 142.6° |
| H15 | C15 | N5 | H5 | 153.0° | 159.9° |
| H15 | C15 | C14 | H141 | 64.1° | 175.1° |
| H15 | C15 | C14 | H142 | 53.5° | 65.0° |
| H5 | N5 | C17 | H171 | 60.3° | 179.1° |
| H5 | N5 | C17 | H172 | 179.7° | 59.1° |
| H5 | N5 | C17 | H173 | 59.7° | 61.0° |
| H171 | C17 | H172 | H173 | 119.9° | 119.9° |
| H111 | C11 | C10 | H101 | 69.1° | 180.0° |
| H111 | C11 | C10 | H102 | 170.9° | 60.1° |
| H112 | C11 | C10 | H101 | 52.0° | 60.0° |
| H112 | C11 | C10 | H102 | 68.0° | 180.0° |
| H101 | C10 | N1 | H1 | 134.6° | 120.0° |
| H102 | C10 | N1 | H1 | 14.7° | 120.0° |
| H3 | C3 | C2 | H2 | 0.3° | 0.1° |
| HA | C5 | C6 | HC | 1.3° | 0.0° |
